Despite great recent advances achieved by deep neural networks (DNNs), they are often vulnerable to adversarial attacks. Intensive research efforts have been made to improve the robustness of DNNs; however, most empirical defenses can be adaptively attacked again, and the theoretically certified robustness is limited, especially on large-scale datasets. One potential root cause of such vulnerabilities for DNNs is that although they have demonstrated powerful expressiveness, they lack the reasoning ability to make robust and reliable predictions. In this paper, we aim to integrate domain knowledge to enable robust learning with the reasoning paradigm. In particular, we propose a certifiably robust learning with reasoning pipeline (CARE), which consists of a learning component and a reasoning component. Concretely, we use a set of standard DNNs to serve as the learning component to make semantic predictions, and we leverage the probabilistic graphical models, such as Markov logic networks (MLN), to serve as the reasoning component to enable knowledge/logic reasoning. However, it is known that the exact inference of MLN (reasoning) is #P-complete, which limits the scalability of the pipeline. To this end, we propose to approximate the MLN inference via variational inference based on an efficient expectation maximization algorithm. In particular, we leverage graph convolutional networks (GCNs) to encode the posterior distribution during variational inference and update the parameters of GCNs (E-step) and the weights of knowledge rules in MLN (M-step) iteratively. We conduct extensive experiments on different datasets and show that CARE achieves significantly higher certified robustness compared with the state-of-the-art baselines. We additionally conducted different ablation studies to demonstrate the empirical robustness of CARE and the effectiveness of different knowledge integration.  ( 2 min )

The relevance of machine learning (ML) in our daily lives is closely intertwined with its explainability. Explainability can allow end-users to have a transparent and humane reckoning of a ML scheme's capability and utility. It will also foster the user's confidence in the automated decisions of a system. Explaining the variables or features to explain a model's decision is a need of the present times. We could not really find any work, which explains the features on the basis of their class-distinguishing abilities (specially when the real world data are mostly of multi-class nature). In any given dataset, a feature is not equally good at making distinctions between the different possible categorizations (or classes) of the data points. In this work, we explain the features on the basis of their class or category-distinguishing capabilities. We particularly estimate the class-distinguishing capabilities (scores) of the variables for pair-wise class combinations. We validate the explainability given by our scheme empirically on several real-world, multi-class datasets. We further utilize the class-distinguishing scores in a latent feature context and propose a novel decision making protocol. Another novelty of this work lies with a \emph{refuse to render decision} option when the latent variable (of the test point) has a high class-distinguishing potential for the likely classes.  ( 2 min )

Continuous, automated surveillance systems that incorporate machine learning models are becoming increasingly common in healthcare environments. These models can capture temporally dependent changes across multiple patient variables and can enhance a clinician's situational awareness by providing an early warning alarm of an impending adverse event such as sepsis. However, most commonly used methods, e.g., XGBoost, fail to provide an interpretable mechanism for understanding why a model produced a sepsis alarm at a given time. The ``black box'' nature of many models is a severe limitation as it prevents clinicians from independently corroborating those physiologic features that have contributed to the sepsis alarm. To overcome this limitation, we propose a generalized linear model (GLM) approach to fit a Granger causal graph based on the physiology of several major sepsis-associated derangements (SADs). We adopt a recently developed stochastic monotone variational inequality (VI)-based estimator coupled with forwarding feature selection to learn the graph structure from both continuous and discrete-valued as well as regularly and irregularly sampled time series. Theoretically, we develop a non-asymptotic upper bound on the estimation error for any monotone link function in the GLM. Using synthetic and real-data examples, we demonstrate that the proposed method enjoys result interpretability while achieving comparable performance to popular methods such as XGBoost.  ( 2 min )

Sharing medical datasets between hospitals is challenging because of the privacy-protection problem and the massive cost of transmitting and storing many high-resolution medical images. However, dataset distillation can synthesize a small dataset such that models trained on it achieve comparable performance with the original large dataset, which shows potential for solving the existing medical sharing problems. Hence, this paper proposes a novel dataset distillation-based method for medical dataset sharing. Experimental results on a COVID-19 chest X-ray image dataset show that our method can achieve high detection performance even using scarce anonymized chest X-ray images.  ( 2 min )

To lower the communication complexity of federated min-max learning, a natural approach is to utilize the idea of infrequent communications (through multiple local updates) same as in conventional federated learning. However, due to the more complicated inter-outer problem structure in federated min-max learning, theoretical understandings of communication complexity for federated min-max learning with infrequent communications remain very limited in the literature. This is particularly true for settings with non-i.i.d. datasets and partial client participation. To address this challenge, in this paper, we propose a new algorithmic framework called stochastic sampling averaging gradient descent ascent (SAGDA), which i) assembles stochastic gradient estimators from randomly sampled clients as control variates and ii) leverages two learning rates on both server and client sides. We show that SAGDA achieves a linear speedup in terms of both the number of clients and local update steps, which yields an $\mathcal{O}(\epsilon^{-2})$ communication complexity that is orders of magnitude lower than the state of the art. Interestingly, by noting that the standard federated stochastic gradient descent ascent (FSGDA) is in fact a control-variate-free special version of SAGDA, we immediately arrive at an $\mathcal{O}(\epsilon^{-2})$ communication complexity result for FSGDA. Therefore, through the lens of SAGDA, we also advance the current understanding on communication complexity of the standard FSGDA method for federated min-max learning.  ( 2 min )

A key assumption in most existing works on FL algorithms' convergence analysis is that the noise in stochastic first-order information has a finite variance. Although this assumption covers all light-tailed (i.e., sub-exponential) and some heavy-tailed noise distributions (e.g., log-normal, Weibull, and some Pareto distributions), it fails for many fat-tailed noise distributions (i.e., ``heavier-tailed'' with potentially infinite variance) that have been empirically observed in the FL literature. To date, it remains unclear whether one can design convergent algorithms for FL systems that experience fat-tailed noise. This motivates us to fill this gap in this paper by proposing an algorithmic framework called FAT-Clipping (\ul{f}ederated \ul{a}veraging with \ul{t}wo-sided learning rates and \ul{clipping}), which contains two variants: FAT-Clipping per-round (FAT-Clipping-PR) and FAT-Clipping per-iteration (FAT-Clipping-PI). Specifically, for the largest $\alpha \in (1,2]$ such that the fat-tailed noise in FL still has a bounded $\alpha$-moment, we show that both variants achieve $\mathcal{O}((mT)^{\frac{2-\alpha}{\alpha}})$ and $\mathcal{O}((mT)^{\frac{1-\alpha}{3\alpha-2}})$ convergence rates in the strongly-convex and general non-convex settings, respectively, where $m$ and $T$ are the numbers of clients and communication rounds. Moreover, at the expense of more clipping operations compared to FAT-Clipping-PR, FAT-Clipping-PI further enjoys a linear speedup effect with respect to the number of local updates at each client and being lower-bound-matching (i.e., order-optimal). Collectively, our results advance the understanding of designing efficient algorithms for FL systems that exhibit fat-tailed first-order oracle information.  ( 2 min )

Sociability is essential for modern robots to increase their acceptability in human environments. Traditional techniques use manually engineered utility functions inspired by observing pedestrian behaviors to achieve social navigation. However, social aspects of navigation are diverse, changing across different types of environments, societies, and population densities, making it unrealistic to use hand-crafted techniques in each domain. This paper presents a data-driven navigation architecture that uses state-of-the-art neural architectures, namely Conditional Neural Processes, to learn global and local controllers of the mobile robot from observations. Additionally, we leverage a state-of-the-art, deep prediction mechanism to detect situations not similar to the trained ones, where reactive controllers step in to ensure safe navigation. Our results demonstrate that the proposed framework can successfully carry out navigation tasks regarding social norms in the data. Further, we showed that our system produces fewer personal-zone violations, causing less discomfort.  ( 2 min )

In many contexts, simpler models are preferable to more complex models and the control of this model complexity is the goal for many methods in machine learning such as regularization, hyperparameter tuning and architecture design. In deep learning, it has been difficult to understand the underlying mechanisms of complexity control, since many traditional measures are not naturally suitable for deep neural networks. Here we develop the notion of geometric complexity, which is a measure of the variability of the model function, computed using a discrete Dirichlet energy. Using a combination of theoretical arguments and empirical results, we show that many common training heuristics such as parameter norm regularization, spectral norm regularization, flatness regularization, implicit gradient regularization, noise regularization and the choice of parameter initialization all act to control geometric complexity, providing a unifying framework in which to characterize the behavior of deep learning models.  ( 2 min )

Despite its great success, backpropagation has certain limitations that necessitate the investigation of new learning methods. In this study, we present a biologically plausible local learning rule that improves upon Hebb's well-known proposal and discovers unsupervised features by local competitions among neurons. This simple learning rule enables the creation of a forward learning paradigm called activation learning, in which the output activation (sum of the squared output) of the neural network estimates the likelihood of the input patterns, or "learn more, activate more" in simpler terms. For classification on a few small classical datasets, activation learning performs comparably to backpropagation using a fully connected network, and outperforms backpropagation when there are fewer training samples or unpredictable disturbances. Additionally, the same trained network can be used for a variety of tasks, including image generation and completion. Activation learning also achieves state-of-the-art performance on several real-world datasets for anomaly detection. This new learning paradigm, which has the potential to unify supervised, unsupervised, and semi-supervised learning and is reasonably more resistant to adversarial attacks, deserves in-depth investigation.  ( 2 min )

Many current approaches to machine learning in particle physics use generic architectures that require large numbers of parameters and disregard underlying physics principles, limiting their applicability as scientific modeling tools. In this work, we present a machine learning architecture that uses a set of inputs maximally reduced with respect to the full 6-dimensional Lorentz symmetry, and is fully permutation-equivariant throughout. We study the application of this network architecture to the standard task of top quark tagging and show that the resulting network outperforms all existing competitors despite much lower model complexity. In addition, we present a Lorentz-covariant variant of the same network applied to a 4-momentum regression task.  ( 2 min )

Decision-making problems are commonly formulated as optimization problems, which are then solved to make optimal decisions. In this work, we consider the inverse problem where we use prior decision data to uncover the underlying decision-making process in the form of a mathematical optimization model. This statistical learning problem is referred to as data-driven inverse optimization. We focus on problems where the underlying decision-making process is modeled as a convex optimization problem whose parameters are unknown. We formulate the inverse optimization problem as a bilevel program and propose an efficient block coordinate descent-based algorithm to solve large problem instances. Numerical experiments on synthetic datasets demonstrate the computational advantage of our method compared to standard commercial solvers. Moreover, the real-world utility of the proposed approach is highlighted through two realistic case studies in which we consider estimating risk preferences and learning local constraint parameters of agents in a multiplayer Nash bargaining game.  ( 2 min )

Generalized Eigenvalue Problems (GEPs) encompass a range of interesting dimensionality reduction methods. Development of efficient stochastic approaches to these problems would allow them to scale to larger datasets. Canonical Correlation Analysis (CCA) is one example of a GEP for dimensionality reduction which has found extensive use in problems with two or more views of the data. Deep learning extensions of CCA require large mini-batch sizes, and therefore large memory consumption, in the stochastic setting to achieve good performance and this has limited its application in practice. Inspired by the Generalized Hebbian Algorithm, we develop an approach to solving stochastic GEPs in which all constraints are softly enforced by Lagrange multipliers. Then by considering the integral of this Lagrangian function, its pseudo-utility, and inspired by recent formulations of Principal Components Analysis and GEPs as games with differentiable utilities, we develop a game-theory inspired approach to solving GEPs. We show that our approaches share much of the theoretical grounding of the previous Hebbian and game theoretic approaches for the linear case but our method permits extension to general function approximators like neural networks for certain GEPs for dimensionality reduction including CCA which means our method can be used for deep multiview representation learning. We demonstrate the effectiveness of our method for solving GEPs in the stochastic setting using canonical multiview datasets and demonstrate state-of-the-art performance for optimizing Deep CCA.  ( 2 min )

In this work, we introduce a learning model designed to meet the needs of applications in which computational resources are limited, and robustness and interpretability are prioritized. Learning problems can be formulated as constrained stochastic optimization problems, with the constraints originating mainly from model assumptions that define a trade-off between complexity and performance. This trade-off is closely related to over-fitting, generalization capacity, and robustness to noise and adversarial attacks, and depends on both the structure and complexity of the model, as well as the properties of the optimization methods used. We develop an online prototype-based learning algorithm based on annealing optimization that is formulated as an online gradient-free stochastic approximation algorithm. The learning model can be viewed as an interpretable and progressively growing competitive-learning neural network model to be used for supervised, unsupervised, and reinforcement learning. The annealing nature of the algorithm contributes to minimal hyper-parameter tuning requirements, poor local minima prevention, and robustness with respect to the initial conditions. At the same time, it provides online control over the performance-complexity trade-off by progressively increasing the complexity of the learning model as needed, through an intuitive bifurcation phenomenon. Finally, the use of stochastic approximation enables the study of the convergence of the learning algorithm through mathematical tools from dynamical systems and control, and allows for its integration with reinforcement learning algorithms, constructing an adaptive state-action aggregation scheme.  ( 2 min )

This paper concerns the central issues of model robustness and sample efficiency in offline reinforcement learning (RL), which aims to learn to perform decision making from history data without active exploration. Due to uncertainties and variabilities of the environment, it is critical to learn a robust policy -- with as few samples as possible -- that performs well even when the deployed environment deviates from the nominal one used to collect the history dataset. We consider a distributionally robust formulation of offline RL, focusing on tabular robust Markov decision processes with an uncertainty set specified by the Kullback-Leibler divergence in both finite-horizon and infinite-horizon settings. To combat with sample scarcity, a model-based algorithm that combines distributionally robust value iteration with the principle of pessimism in the face of uncertainty is proposed, by penalizing the robust value estimates with a carefully designed data-driven penalty term. Under a mild and tailored assumption of the history dataset that measures distribution shift without requiring full coverage of the state-action space, we establish the finite-sample complexity of the proposed algorithm, and further show it is almost unimprovable in light of a nearly-matching information-theoretic lower bound up to a polynomial factor of the (effective) horizon length. To the best our knowledge, this provides the first provably near-optimal robust offline RL algorithm that learns under model uncertainty and partial coverage.  ( 2 min )

Causal mediation analysis can unpack the black box of causality and is therefore a powerful tool for disentangling causal pathways in biomedical and social sciences, and also for evaluating machine learning fairness. To reduce bias for estimating Natural Direct and Indirect Effects in mediation analysis, we propose a new method called DeepMed that uses deep neural networks (DNNs) to cross-fit the infinite-dimensional nuisance functions in the efficient influence functions. We obtain novel theoretical results that our DeepMed method (1) can achieve semiparametric efficiency bound without imposing sparsity constraints on the DNN architecture and (2) can adapt to certain low dimensional structures of the nuisance functions, significantly advancing the existing literature on DNN-based semiparametric causal inference. Extensive synthetic experiments are conducted to support our findings and also expose the gap between theory and practice. As a proof of concept, we apply DeepMed to analyze two real datasets on machine learning fairness and reach conclusions consistent with previous findings.  ( 2 min )

Recent literature has advocated the use of randomized methods for accelerating the solution of various matrix problems arising throughout data science and computational science. One popular strategy for leveraging randomization is to use it as a way to reduce problem size. However, methods based on this strategy lack sufficient accuracy for some applications. Randomized preconditioning is another approach for leveraging randomization, which provides higher accuracy. The main challenge in using randomized preconditioning is the need for an underlying iterative method, thus randomized preconditioning so far have been applied almost exclusively to solving regression problems and linear systems. In this article, we show how to expand the application of randomized preconditioning to another important set of problems prevalent across data science: optimization problems with (generalized) orthogonality constraints. We demonstrate our approach, which is based on the framework of Riemannian optimization and Riemannian preconditioning, on the problem of computing the dominant canonical correlations and on the Fisher linear discriminant analysis problem. For both problems, we evaluate the effect of preconditioning on the computational costs and asymptotic convergence, and demonstrate empirically the utility of our approach.  ( 2 min )

An oft-cited open problem of federated learning is the existence of data heterogeneity at the clients. One pathway to understanding the drastic accuracy drop in federated learning is by scrutinizing the behavior of the clients' deep models on data with different levels of "difficulty", which has been left unaddressed. In this paper, we investigate a different and rarely studied dimension of FL: ordered learning. Specifically, we aim to investigate how ordered learning principles can contribute to alleviating the heterogeneity effects in FL. We present theoretical analysis and conduct extensive empirical studies on the efficacy of orderings spanning three kinds of learning: curriculum, anti-curriculum, and random curriculum. We find that curriculum learning largely alleviates non-IIDness. Interestingly, the more disparate the data distributions across clients the more they benefit from ordered learning. We provide analysis explaining this phenomenon, specifically indicating how curriculum training appears to make the objective landscape progressively less convex, suggesting fast converging iterations at the beginning of the training procedure. We derive quantitative results of convergence for both convex and nonconvex objectives by modeling the curriculum training on federated devices as local SGD with locally biased stochastic gradients. Also, inspired by ordered learning, we propose a novel client selection technique that benefits from the real-world disparity in the clients. Our proposed approach to client selection has a synergic effect when applied together with ordered learning in FL.  ( 2 min )

In a sequential decision-making problem, having a structural dependency amongst the reward distributions associated with the arms makes it challenging to identify a subset of alternatives that guarantees the optimal collective outcome. Thus, besides individual actions' reward, learning the causal relations is essential to improve the decision-making strategy. To solve the two-fold learning problem described above, we develop the 'combinatorial semi-bandit framework with causally related rewards', where we model the causal relations by a directed graph in a stationary structural equation model. The nodal observation in the graph signal comprises the corresponding base arm's instantaneous reward and an additional term resulting from the causal influences of other base arms' rewards. The objective is to maximize the long-term average payoff, which is a linear function of the base arms' rewards and depends strongly on the network topology. To achieve this objective, we propose a policy that determines the causal relations by learning the network's topology and simultaneously exploits this knowledge to optimize the decision-making process. We establish a sublinear regret bound for the proposed algorithm. Numerical experiments using synthetic and real-world datasets demonstrate the superior performance of our proposed method compared to several benchmarks.  ( 2 min )

Investigation and analysis of patient outcomes, including in-hospital mortality and length of stay, are crucial for assisting clinicians in determining a patient's result at the outset of their hospitalization and for assisting hospitals in allocating their resources. This paper proposes an approach based on combining the well-known gray wolf algorithm with frequent items extracted by association rule mining algorithms. First, original features are combined with the discriminative extracted frequent items. The best subset of these features is then chosen, and the parameters of the used classification algorithms are also adjusted, using the gray wolf algorithm. This framework was evaluated using a real dataset made up of 2816 patients from the Imam Ali Kermanshah Hospital in Iran. The study's findings indicate that low Ejection Fraction, old age, high CPK values, and high Creatinine levels are the main contributors to patients' mortality. Several significant and interesting rules related to mortality in hospitals and length of stay have also been extracted and presented. Additionally, the accuracy, sensitivity, specificity, and auroc of the proposed framework for the diagnosis of mortality in the hospital using the SVM classifier were 0.9961, 0.9477, 0.9992, and 0.9734, respectively. According to the framework's findings, adding frequent items as features considerably improves classification accuracy.  ( 2 min )

Document summarization aims to create a precise and coherent summary of a text document. Many deep learning summarization models are developed mainly for English, often requiring a large training corpus and efficient pre-trained language models and tools. However, English summarization models for low-resource Indian languages are often limited by rich morphological variation, syntax, and semantic differences. In this paper, we propose GAE-ISumm, an unsupervised Indic summarization model that extracts summaries from text documents. In particular, our proposed model, GAE-ISumm uses Graph Autoencoder (GAE) to learn text representations and a document summary jointly. We also provide a manually-annotated Telugu summarization dataset TELSUM, to experiment with our model GAE-ISumm. Further, we experiment with the most publicly available Indian language summarization datasets to investigate the effectiveness of GAE-ISumm on other Indian languages. Our experiments of GAE-ISumm in seven languages make the following observations: (i) it is competitive or better than state-of-the-art results on all datasets, (ii) it reports benchmark results on TELSUM, and (iii) the inclusion of positional and cluster information in the proposed model improved the performance of summaries.  ( 2 min )

In this paper, we consider an intelligent reflecting surface (IRS)-aided cell-free massive multiple-input multiple-output system, where the beamforming at access points and the phase shifts at IRSs are jointly optimized to maximize energy efficiency (EE). To solve EE maximization problem, we propose an iterative optimization algorithm by using quadratic transform and Lagrangian dual transform to find the optimum beamforming and phase shifts. However, the proposed algorithm suffers from high computational complexity, which hinders its application in some practical scenarios. Responding to this, we further propose a deep learning based approach for joint beamforming and phase shifts design. Specifically, a two-stage deep neural network is trained offline using the unsupervised learning manner, which is then deployed online for the predictions of beamforming and phase shifts. Simulation results show that compared with the iterative optimization algorithm and the genetic algorithm, the unsupervised learning based approach has higher EE performance and lower running time.  ( 2 min )

Deep neural networks have long training and processing times. Early exits added to neural networks allow the network to make early predictions using intermediate activations in the network in time-sensitive applications. However, early exits increase the training time of the neural networks. We introduce QuickNets: a novel cascaded training algorithm for faster training of neural networks. QuickNets are trained in a layer-wise manner such that each successive layer is only trained on samples that could not be correctly classified by the previous layers. We demonstrate that QuickNets can dynamically distribute learning and have a reduced training cost and inference cost compared to standard Backpropagation. Additionally, we introduce commitment layers that significantly improve the early exits by identifying for over-confident predictions and demonstrate its success.  ( 2 min )

Reinforcement learning (RL) problems can be challenging without well-shaped rewards. Prior work on provably efficient RL methods generally proposes to address this issue with dedicated exploration strategies. However, another way to tackle this challenge is to reformulate it as a multi-task RL problem, where the task space contains not only the challenging task of interest but also easier tasks that implicitly function as a curriculum. Such a reformulation opens up the possibility of running existing multi-task RL methods as a more efficient alternative to solving a single challenging task from scratch. In this work, we provide a theoretical framework that reformulates a single-task RL problem as a multi-task RL problem defined by a curriculum. Under mild regularity conditions on the curriculum, we show that sequentially solving each task in the multi-task RL problem is more computationally efficient than solving the original single-task problem, without any explicit exploration bonuses or other exploration strategies. We also show that our theoretical insights can be translated into an effective practical learning algorithm that can accelerate curriculum learning on simulated robotic tasks.  ( 2 min )

Designing spectral convolutional networks is a challenging problem in graph learning. ChebNet, one of the early attempts, approximates the spectral graph convolutions using Chebyshev polynomials. GCN simplifies ChebNet by utilizing only the first two Chebyshev polynomials while still outperforming it on real-world datasets. GPR-GNN and BernNet demonstrate that the Monomial and Bernstein bases also outperform the Chebyshev basis in terms of learning the spectral graph convolutions. Such conclusions are counter-intuitive in the field of approximation theory, where it is established that the Chebyshev polynomial achieves the optimum convergent rate for approximating a function. In this paper, we revisit the problem of approximating the spectral graph convolutions with Chebyshev polynomials. We show that ChebNet's inferior performance is primarily due to illegal coefficients learnt by ChebNet approximating analytic filter functions, which leads to over-fitting. We then propose ChebNetII, a new GNN model based on Chebyshev interpolation, which enhances the original Chebyshev polynomial approximation while reducing the Runge phenomenon. We conducted an extensive experimental study to demonstrate that ChebNetII can learn arbitrary graph convolutions and achieve superior performance in both full- and semi-supervised node classification tasks. Most notably, we scale ChebNetII to a billion graph ogbn-papers100M, showing that spectral-based GNNs have superior performance. Our code is available at https://github.com/ivam-he/ChebNetII.

As machine learning algorithms are deployed on sensitive data in critical decision making processes, it is becoming increasingly important that they are also private and fair. In this paper, we show that, when the data has a long-tailed structure, it is not possible to build accurate learning algorithms that are both private and results in higher accuracy on minority subpopulations. We further show that relaxing overall accuracy can lead to good fairness even with strict privacy requirements. To corroborate our theoretical results in practice, we provide an extensive set of experimental results using a variety of synthetic, vision (CIFAR10 and CelebA), and tabular (Law School) datasets and learning algorithms.

In explanatory interactive learning (XIL) the user queries the learner, then the learner explains its answer to the user and finally the loop repeats. XIL is attractive for two reasons, (1) the learner becomes better and (2) the user's trust increases. For both reasons to hold, the learner's explanations must be useful to the user and the user must be allowed to ask useful questions. Ideally, both questions and explanations should be grounded in a causal model since they avoid spurious fallacies. Ultimately, we seem to seek a causal variant of XIL. The question part on the user's end we believe to be solved since the user's mental model can provide the causal model. But how would the learner provide causal explanations? In this work we show that existing explanation methods are not guaranteed to be causal even when provided with a Structural Causal Model (SCM). Specifically, we use the popular, proclaimed causal explanation method CXPlain to illustrate how the generated explanations leave open the question of truly causal explanations. Thus as a step towards causal XIL, we propose a solution to the lack of causal explanations. We solve this problem by deriving from first principles an explanation method that makes full use of a given SCM, which we refer to as SC$\textbf{E}$ ($\textbf{E}$ standing for explanation). Since SCEs make use of structural information, any causal graph learner can now provide human-readable explanations. We conduct several experiments including a user study with 22 participants to investigate the virtue of SCE as causal explanations of SCMs.

Transformer-based pretrained language models (LMs) are ubiquitous across natural language understanding, but cannot be applied to long sequences such as stories, scientific articles and long documents, due to their quadratic complexity. While a myriad of efficient transformer variants have been proposed, they are typically based on custom implementations that require expensive pretraining from scratch.In this work, we propose SLED: SLiding-Encoder and Decoder, a simple approach for processing long sequences that re-uses and leverages battle-tested short-text pretrained LMs. Specifically, we partition the input into overlapping chunks, encode each with a short-text LM encoder and use the pretrained decoder to fuse information across chunks (fusion-in-decoder). We illustrate through controlled experiments that SLED offers a viable strategy for long text understanding and evaluate our approach on SCROLLS, a benchmark with seven datasets across a wide range of language understanding tasks. We find that SLED is competitive with specialized models that are up to 50x larger and require a dedicated and expensive pretraining step.

Closed-circuit video (CCTV) inspection has been the most popular technique for visually evaluating the interior status of pipelines in recent decades. Certified inspectors prepare the pipe repair document based on the CCTV inspection. The traditional manual method of assessing sewage structural conditions from pipe repair documents takes a long time and is prone to human mistakes. The automatic identification of necessary texts has received little attention. By building an automated framework employing Natural Language Processing (NLP), this study presents an effective technique to automate the identification of the pipe defect rating of the pipe repair documents. NLP technologies are employed to break down textual material into grammatical units in this research. Further analysis entails using words to discover pipe defect symptoms and their frequency and then combining that information into a single score. Our model achieves 95.0% accuracy,94.9% sensitivity, 94.4% specificity, 95.9% precision score, and 95.7% F1 score, showing the potential of the proposed model to be used in large-scale pipe repair documents for accurate and efficient pipeline failure detection to improve the quality of the pipeline. Keywords: Sewer pipe inspection, Defect detection, Natural language processing, Text recognition

We propose a multi-agent reinforcement learning dynamics, and analyze its convergence properties in infinite-horizon discounted Markov potential games. We focus on the independent and decentralized setting, where players can only observe the realized state and their own reward in every stage. Players do not have knowledge of the game model, and cannot coordinate with each other. In each stage of our learning dynamics, players update their estimate of a perturbed Q-function that evaluates their total contingent payoff based on the realized one-stage reward in an asynchronous manner. Then, players independently update their policies by incorporating a smoothed optimal one-stage deviation strategy based on the estimated Q-function. A key feature of the learning dynamics is that the Q-function estimates are updated at a faster timescale than the policies. We prove that the policies induced by our learning dynamics converge to a stationary Nash equilibrium in Markov potential games with probability 1. Our results demonstrate that agents can reach a stationary Nash equilibrium in Markov potential games through simple learning dynamics under the minimum information environment.

Platelet products are both expensive and have very short shelf lives. As usage rates for platelets are highly variable, the effective management of platelet demand and supply is very important yet challenging. The primary goal of this paper is to present an efficient forecasting model for platelet demand at Canadian Blood Services (CBS). To accomplish this goal, four different demand forecasting methods, ARIMA (Auto Regressive Moving Average), Prophet, lasso regression (least absolute shrinkage and selection operator) and LSTM (Long Short-Term Memory) networks are utilized and evaluated. We use a large clinical dataset for a centralized blood distribution centre for four hospitals in Hamilton, Ontario, spanning from 2010 to 2018 and consisting of daily platelet transfusions along with information such as the product specifications, the recipients' characteristics, and the recipients' laboratory test results. This study is the first to utilize different methods from statistical time series models to data-driven regression and a machine learning technique for platelet transfusion using clinical predictors and with different amounts of data. We find that the multivariate approaches have the highest accuracy in general, however, if sufficient data are available, a simpler time series approach such as ARIMA appears to be sufficient. We also comment on the approach to choose clinical indicators (inputs) for the multivariate models.

Deep learning has achieved great success in the past few years. However, the performance of deep learning is likely to impede in face of non-IID situations. Domain generalization (DG) enables a model to generalize to an unseen test distribution, i.e., to learn domain-invariant representations. In this paper, we argue that domain-invariant features should be originating from both internal and mutual sides. Internal invariance means that the features can be learned with a single domain and the features capture intrinsic semantics of data, i.e., the property within a domain, which is agnostic to other domains. Mutual invariance means that the features can be learned with multiple domains (cross-domain) and the features contain common information, i.e., the transferable features w.r.t. other domains. We then propose DIFEX for Domain-Invariant Feature EXploration. DIFEX employs a knowledge distillation framework to capture the high-level Fourier phase as the internally-invariant features and learn cross-domain correlation alignment as the mutually-invariant features. We further design an exploration loss to increase the feature diversity for better generalization. Extensive experiments on both time-series and visual benchmarks demonstrate that the proposed DIFEX achieves state-of-the-art performance.

We present a new technique for the accelerated training of physics-informed neural networks (PINNs): discretely-trained PINNs (DT-PINNs). The repeated computation of partial derivative terms in the PINN loss functions via automatic differentiation during training is known to be computationally expensive, especially for higher-order derivatives. DT-PINNs are trained by replacing these exact spatial derivatives with high-order accurate numerical discretizations computed using meshless radial basis function-finite differences (RBF-FD) and applied via sparse-matrix vector multiplication. The use of RBF-FD allows for DT-PINNs to be trained even on point cloud samples placed on irregular domain geometries. Additionally, though traditional PINNs (vanilla-PINNs) are typically stored and trained in 32-bit floating-point (fp32) on the GPU, we show that for DT-PINNs, using fp64 on the GPU leads to significantly faster training times than fp32 vanilla-PINNs with comparable accuracy. We demonstrate the efficiency and accuracy of DT-PINNs via a series of experiments. First, we explore the effect of network depth on both numerical and automatic differentiation of a neural network with random weights and show that RBF-FD approximations of third-order accuracy and above are more efficient while being sufficiently accurate. We then compare the DT-PINNs to vanilla-PINNs on both linear and nonlinear Poisson equations and show that DT-PINNs achieve similar losses with 2-4x faster training times on a consumer GPU. Finally, we also demonstrate that similar results can be obtained for the PINN solution to the heat equation (a space-time problem) by discretizing the spatial derivatives using RBF-FD and using automatic differentiation for the temporal derivative. Our results show that fp64 DT-PINNs offer a superior cost-accuracy profile to fp32 vanilla-PINNs.

Since the traffic conditions change over time, machine learning models that predict traffic flows must be updated continuously and efficiently in smart public transportation. Federated learning (FL) is a distributed machine learning scheme that allows buses to receive model updates without waiting for model training on the cloud. However, FL is vulnerable to poisoning or DDoS attacks since buses travel in public. Some work introduces blockchain to improve reliability, but the additional latency from the consensus process reduces the efficiency of FL. Asynchronous Federated Learning (AFL) is a scheme that reduces the latency of aggregation to improve efficiency, but the learning performance is unstable due to unreasonably weighted local models. To address the above challenges, this paper offers a blockchain-based asynchronous federated learning scheme with a dynamic scaling factor (DBAFL). Specifically, the novel committee-based consensus algorithm for blockchain improves reliability at the lowest possible cost of time. Meanwhile, the devised dynamic scaling factor allows AFL to assign reasonable weights to stale local models. Extensive experiments conducted on heterogeneous devices validate outperformed learning performance, efficiency, and reliability of DBAFL.

This work proposes a decentralized architecture, where individual agents aim at solving a classification problem while observing streaming features of different dimensions and arising from possibly different distributions. In the context of social learning, several useful strategies have been developed, which solve decision making problems through local cooperation across distributed agents and allow them to learn from streaming data. However, traditional social learning strategies rely on the fundamental assumption that each agent has significant prior knowledge of the underlying distribution of the observations. In this work we overcome this issue by introducing a machine learning framework that exploits social interactions over a graph, leading to a fully data-driven solution to the distributed classification problem. In the proposed social machine learning (SML) strategy, two phases are present: in the training phase, classifiers are independently trained to generate a belief over a set of hypotheses using a finite number of training samples; in the prediction phase, classifiers evaluate streaming unlabeled observations and share their instantaneous beliefs with neighboring classifiers. We show that the SML strategy enables the agents to learn consistently under this highly-heterogeneous setting and allows the network to continue learning even during the prediction phase when it is deciding on unlabeled samples. The prediction decisions are used to continually improve performance thereafter in a manner that is markedly different from most existing static classification schemes where, following training, the decisions on unlabeled data are not re-used to improve future performance.

Most modern probabilistic generative models, such as the variational autoencoder (VAE), have certain indeterminacies that are unresolvable even with an infinite amount of data. Different tasks tolerate different indeterminacies, however recent applications have indicated the need for strongly identifiable models, in which an observation corresponds to a unique latent code. Progress has been made towards reducing model indeterminacies while maintaining flexibility, and recent work excludes many--but not all--indeterminacies. In this work, we motivate model-identifiability in terms of task-identifiability, then construct a theoretical framework for analyzing the indeterminacies of latent variable models, which enables their precise characterization in terms of the generator function and prior distribution spaces. We reveal that strong identifiability is possible even with highly flexible nonlinear generators, and give two such examples. One is a straightforward modification of iVAE (arXiv:1907.04809 [stat.ML]); the other uses triangular monotonic maps, leading to novel connections between optimal transport and identifiability.

In this work, we propose ModelPred, a framework that helps to understand the impact of changes in training data on a trained model. This is critical for building trust in various stages of a machine learning pipeline: from cleaning poor-quality samples and tracking important ones to be collected during data preparation, to calibrating uncertainty of model prediction, to interpreting why certain behaviors of a model emerge during deployment. Specifically, ModelPred learns a parameterized function that takes a dataset $S$ as the input and predicts the model obtained by training on $S$. Our work differs from the recent work of Datamodels [1] as we aim for predicting the trained model parameters directly instead of the trained model behaviors. We demonstrate that a neural network-based set function class is capable of learning the complex relationships between the training data and model parameters. We introduce novel global and local regularization techniques to prevent overfitting and we rigorously characterize the expressive power of neural networks (NN) in approximating the end-to-end training process. Through extensive empirical investigations, we show that ModelPred enables a variety of applications that boost the interpretability and accountability of machine learning (ML), such as data valuation, data selection, memorization quantification, and model calibration.

We propose an efficient method to learn both unstructured and structured sparse neural networks during training, using a novel generalization of the sparse envelope function (SEF) used as a regularizer, termed {\itshape{group sparse envelope function}} (GSEF). The GSEF acts as a neuron group selector, which we leverage to induce structured pruning. Our method receives a hardware-friendly structured sparsity of a deep neural network (DNN) to efficiently accelerate the DNN's evaluation. This method is flexible in the sense that it allows any hardware to dictate the definition of a group, such as a filter, channel, filter shape, layer depth, a single parameter (unstructured), etc. By the nature of the GSEF, the proposed method is the first to make possible a pre-define sparsity level that is being achieved at the training convergence, while maintaining negligible network accuracy degradation. We propose an efficient method to calculate the exact value of the GSEF along with its proximal operator, in a worst-case complexity of $O(n)$, where $n$ is the total number of groups variables. In addition, we propose a proximal-gradient-based optimization method to train the model, that is, the non-convex minimization of the sum of the neural network loss and the GSEF. Finally, we conduct an experiment and illustrate the efficiency of our proposed technique in terms of the completion ratio, accuracy, and inference latency.

The study of feature propagation at initialization in neural networks lies at the root of numerous initialization designs. An assumption very commonly made in the field states that the pre-activations are Gaussian. Although this convenient Gaussian hypothesis can be justified when the number of neurons per layer tends to infinity, it is challenged by both theoretical and experimental works for finite-width neural networks. Our major contribution is to construct a family of pairs of activation functions and initialization distributions that ensure that the pre-activations remain Gaussian throughout the network's depth, even in narrow neural networks. In the process, we discover a set of constraints that a neural network should fulfill to ensure Gaussian pre-activations. Additionally, we provide a critical review of the claims of the Edge of Chaos line of works and build an exact Edge of Chaos analysis. We also propose a unified view on pre-activations propagation, encompassing the framework of several well-known initialization procedures. Finally, our work provides a principled framework for answering the much-debated question: is it desirable to initialize the training of a neural network whose pre-activations are ensured to be Gaussian?

Federated Learning (FL) has been widely accepted as the solution for privacy-preserving machine learning without collecting raw data. While new technologies proposed in the past few years do evolve the FL area, unfortunately, the evaluation results presented in these works fall short in integrity and are hardly comparable because of the inconsistent evaluation metrics and experimental settings. In this paper, we propose a holistic evaluation framework for FL called FedEval, and present a benchmarking study on seven state-of-the-art FL algorithms. Specifically, we first introduce the core evaluation taxonomy model, called FedEval-Core, which covers four essential evaluation aspects for FL: Privacy, Robustness, Effectiveness, and Efficiency, with various well-defined metrics and experimental settings. Based on the FedEval-Core, we further develop an FL evaluation platform with standardized evaluation settings and easy-to-use interfaces. We then provide an in-depth benchmarking study between the seven well-known FL algorithms, including FedSGD, FedAvg, FedProx, FedOpt, FedSTC, SecAgg, and HEAgg. We comprehensively analyze the advantages and disadvantages of these algorithms and further identify the suitable practical scenarios for different algorithms, which is rarely done by prior work. Lastly, we excavate a set of take-away insights and future research directions, which are very helpful for researchers in the FL area.

While quantum machine learning (ML) has been proposed to be one of the most promising applications of quantum computing, how to build quantum ML models that outperform classical ML remains a major open question. Here, we demonstrate a Bayesian algorithm for constructing quantum kernels for support vector machines that adapts quantum gate sequences to data. The algorithm increases the complexity of quantum circuits incrementally by appending quantum gates selected with Bayesian information criterion as circuit selection metric and Bayesian optimization of the parameters of the locally optimal quantum circuits identified. The performance of the resulting quantum models for classification problems with a small number of training points significantly exceeds that of optimized classical models with conventional kernels.

We investigate a data quality-aware dynamic client selection problem for multiple federated learning (FL) services in a wireless network, where each client offers dynamic datasets for the simultaneous training of multiple FL services, and each FL service demander has to pay for the clients under constrained monetary budgets. The problem is formalized as a non-cooperative Markov game over the training rounds. A multi-agent hybrid deep reinforcement learning-based algorithm is proposed to optimize the joint client selection and payment actions, while avoiding action conflicts. Simulation results indicate that our proposed algorithm can significantly improve training performance.

We propose, Monte Carlo Nonlocal physics-informed neural networks (MC-Nonlocal-PINNs), which is a generalization of MC-fPINNs in \cite{guo2022monte}, for solving general nonlocal models such as integral equations and nonlocal PDEs. Similar as in MC-fPINNs, our MC-Nonlocal-PINNs handle the nonlocal operators in a Monte Carlo way, resulting in a very stable approach for high dimensional problems. We present a variety of test problems, including high dimensional Volterra type integral equations, hypersingular integral equations and nonlocal PDEs, to demonstrate the effectiveness of our approach.

Optimal transport (OT) has become a widely used tool in the machine learning field to measure the discrepancy between probability distributions. For instance, OT is a popular loss function that quantifies the discrepancy between an empirical distribution and a parametric model. Recently, an entropic penalty term and the celebrated Sinkhorn algorithm have been commonly used to approximate the original OT in a computationally efficient way. However, since the Sinkhorn algorithm runs a projection associated with the Kullback-Leibler divergence, it is often vulnerable to outliers. To overcome this problem, we propose regularizing OT with the \beta-potential term associated with the so-called $\beta$-divergence, which was developed in robust statistics. Our theoretical analysis reveals that the $\beta$-potential can prevent the mass from being transported to outliers. We experimentally demonstrate that the transport matrix computed with our algorithm helps estimate a probability distribution robustly even in the presence of outliers. In addition, our proposed method can successfully detect outliers from a contaminated dataset

Data-driven soft sensors are extensively used in industrial and chemical processes to predict hard-to-measure process variables whose real value is difficult to track during routine operations. The regression models used by these sensors often require a large number of labeled examples, yet obtaining the label information can be very expensive given the high time and cost required by quality inspections. In this context, active learning methods can be highly beneficial as they can suggest the most informative labels to query. However, most of the active learning strategies proposed for regression focus on the offline setting. In this work, we adapt some of these approaches to the stream-based scenario and show how they can be used to select the most informative data points. We also demonstrate how to use a semi-supervised architecture based on orthogonal autoencoders to learn salient features in a lower dimensional space. The Tennessee Eastman Process is used to compare the predictive performance of the proposed approaches.

The stochastic approximation (SA) algorithm is a widely used probabilistic method for finding a zero or a fixed point of a vector-valued funtion, when only noisy measurements of the function are available. In the literature to date, one makes a distinction between ``synchronous'' updating, whereby every component of the current guess is updated at each time, and ``asynchronous'' updating, whereby only one component is updated. In this paper, we study an intermediate situation that we call ``batch asynchronous stochastic approximation'' (BASA), in which, at each time instant, \textit{some but not all} components of the current estimated solution are updated. BASA allows the user to trade off memory requirements against time complexity. We develop a general methodology for proving that such algorithms converge to the fixed point of the map under study. These convergence proofs make use of weaker hypotheses than existing results. Specifically, existing convergence proofs require that the measurement noise is a zero-mean i.i.d\ sequence or a martingale difference sequence. In the present paper, we permit biased measurements, that is, measurement noises that have nonzero conditional mean. Also, all convergence results to date assume that the stochastic step sizes satisfy a probabilistic analog of the well-known Robbins-Monro conditions. We replace this assumption by a purely deterministic condition on the irreducibility of the underlying Markov processes. As specific applications to Reinforcement Learning, we analyze the temporal difference algorithm $TD(\lambda)$ for value iteration, and the $Q$-learning algorithm for finding the optimal action-value function. In both cases, we establish the convergence of these algorithms, under milder conditions than in the existing literature.

We study the close interplay between error and compression in the non-parametric multiclass classification setting in terms of prototype learning rules. We focus in particular on a recently proposed compression-based learning rule termed OptiNet (Kontorovich, Sabato, and Urner 2016; Kontorovich, Sabato, and Weiss 2017; Hanneke et al. 2021). Beyond its computational merits, this rule has been recently shown to be universally consistent in any metric instance space that admits a universally consistent rule--the first learning algorithm known to enjoy this property. However, its error and compression rates have been left open. Here we derive such rates in the case where instances reside in Euclidean space under commonly posed smoothness and tail conditions on the data distribution. We first show that OptiNet achieves non-trivial compression rates while enjoying near minimax-optimal error rates. We then proceed to study a novel general compression scheme for further compressing prototype rules that locally adapts to the noise level without sacrificing accuracy. Applying it to OptiNet, we show that under a geometric margin condition, further gain in the compression rate is achieved. Experimental results comparing the performance of the various methods are presented.

The cross section is one of the most important physical quantities in high-energy physics and the most time consuming to compute. While machine learning has proven to be highly successful in numerical calculations in high-energy physics, analytical calculations using machine learning are still in their infancy. In this work, we use a sequence-to-sequence model, specifically, a transformer, to compute a key element of the cross section calculation, namely, the squared amplitude of an interaction. We show that a transformer model is able to predict correctly 97.6% and 99% of squared amplitudes of QCD and QED processes, respectively, at a speed that is up to orders of magnitude faster than current symbolic computation frameworks. We discuss the performance of the current model, its limitations and possible future directions for this work.

We propose a fairness-aware learning framework that mitigates intersectional subgroup bias associated with protected attributes. Prior research has primarily focused on mitigating one kind of bias by incorporating complex fairness-driven constraints into optimization objectives or designing additional layers that focus on specific protected attributes. We introduce a simple and generic bias mitigation approach that prevents models from learning relationships between protected attributes and output variable by reducing mutual information between them. We demonstrate that our approach is effective in reducing bias with little or no drop in accuracy. We also show that the models trained with our learning framework become causally fair and insensitive to the values of protected attributes. Finally, we validate our approach by studying feature interactions between protected and non-protected attributes. We demonstrate that these interactions are significantly reduced when applying our bias mitigation.

Automated Feature Engineering (AFE) refers to automatically generate and select optimal feature sets for downstream tasks, which has achieved great success in real-world applications. Current AFE methods mainly focus on improving the effectiveness of the produced features, but ignoring the low-efficiency issue for large-scale deployment. Therefore, in this work, we propose a generic framework to improve the efficiency of AFE. Specifically, we construct the AFE pipeline based on reinforcement learning setting, where each feature is assigned an agent to perform feature transformation \com{and} selection, and the evaluation score of the produced features in downstream tasks serve as the reward to update the policy. We improve the efficiency of AFE in two perspectives. On the one hand, we develop a Feature Pre-Evaluation (FPE) Model to reduce the sample size and feature size that are two main factors on undermining the efficiency of feature evaluation. On the other hand, we devise a two-stage policy training strategy by running FPE on the pre-evaluation task as the initialization of the policy to avoid training policy from scratch. We conduct comprehensive experiments on 36 datasets in terms of both classification and regression tasks. The results show $2.9\%$ higher performance in average and 2x higher computational efficiency comparing to state-of-the-art AFE methods.

Foundation Models (FMs) are models trained on large corpora of data that, at very large scale, can generalize to new tasks without any task-specific finetuning. As these models continue to grow in size, innovations continue to push the boundaries of what these models can do on language and image tasks. This paper aims to understand an underexplored area of FMs: classical data tasks like cleaning and integration. As a proof-of-concept, we cast five data cleaning and integration tasks as prompting tasks and evaluate the performance of FMs on these tasks. We find that large FMs generalize and achieve SoTA performance on data cleaning and integration tasks, even though they are not trained for these data tasks. We identify specific research challenges and opportunities that these models present, including challenges with private and domain specific data, and opportunities to make data management systems more accessible to non-experts. We make our code and experiments publicly available at: https://github.com/HazyResearch/fm_data_tasks.

Conventional conversation assistants extract text transcripts from the speech signal using automatic speech recognition (ASR) and then predict intent from the transcriptions. Using end-to-end spoken language understanding (SLU), the intents of the speaker are predicted directly from the speech signal without requiring intermediate text transcripts. As a result, the model can optimize directly for intent classification and avoid cascading errors from ASR. The end-to-end SLU system also helps in reducing the latency of the intent prediction model. Although many datasets are available publicly for text-to-intent tasks, the availability of labeled speech-to-intent datasets is limited, and there are no datasets available in the Indian accent. In this paper, we release the Skit-S2I dataset, the first publicly available Indian-accented SLU dataset in the banking domain in a conversational tonality. We experiment with multiple baselines, compare different pretrained speech encoder's representations, and find that SSL pretrained representations perform slightly better than ASR pretrained representations lacking prosodic features for speech-to-intent classification. The dataset and baseline code is available at \url{https://github.com/skit-ai/speech-to-intent-dataset}

Classically, data interpolation with a parametrized model class is possible as long as the number of parameters is larger than the number of equations to be satisfied. A puzzling phenomenon in deep learning is that models are trained with many more parameters than what this classical theory would suggest. We propose a partial theoretical explanation for this phenomenon. We prove that for a broad class of data distributions and model classes, overparametrization is necessary if one wants to interpolate the data smoothly. Namely we show that smooth interpolation requires $d$ times more parameters than mere interpolation, where $d$ is the ambient data dimension. We prove this universal law of robustness for any smoothly parametrized function class with polynomial size weights, and any covariate distribution verifying isoperimetry. In the case of two-layers neural networks and Gaussian covariates, this law was conjectured in prior work by Bubeck, Li and Nagaraj. We also give an interpretation of our result as an improved generalization bound for model classes consisting of smooth functions.

Decision makers often aim to learn a treatment assignment policy under a capacity constraint on the number of agents that they can treat. When agents can respond strategically to such policies, competition arises, complicating the estimation of the effect of the policy. In this paper, we study capacity-constrained treatment assignment in the presence of such interference. We consider a dynamic model where the decision maker allocates treatments at each time step and heterogeneous agents myopically best respond to the previous treatment assignment policy. When the number of agents is large but finite, we show that the threshold for receiving treatment under a given policy converges to the policy's mean-field equilibrium threshold. Based on this result, we develop a consistent estimator for the policy effect. In simulations and a semi-synthetic experiment with data from the National Education Longitudinal Study of 1988, we demonstrate that this estimator can be used for learning capacity-constrained policies in the presence of strategic behavior.

Heating in private households is a major contributor to the emissions generated today. Heat pumps are a promising alternative for heat generation and are a key technology in achieving our goals of the German energy transformation and to become less dependent on fossil fuels. Today, the majority of heat pumps in the field are controlled by a simple heating curve, which is a naive mapping of the current outdoor temperature to a control action. A more advanced control approach is model predictive control (MPC) which was applied in multiple research works to heat pump control. However, MPC is heavily dependent on the building model, which has several disadvantages. Motivated by this and by recent breakthroughs in the field, this work applies deep reinforcement learning (DRL) to heat pump control in a simulated environment. Through a comparison to MPC, it could be shown that it is possible to apply DRL in a model-free manner to achieve MPC-like performance. This work extends other works which have already applied DRL to building heating operation by performing an in-depth analysis of the learned control strategies and by giving a detailed comparison of the two state-of-the-art control methods.

We present POLAR, a polynomial arithmetic-based framework for efficient bounded-time reachability analysis of neural-network controlled systems (NNCSs). Existing approaches that leverage the standard Taylor Model (TM) arithmetic for approximating the neural-network controller cannot deal with non-differentiable activation functions and suffer from rapid explosion of the remainder when propagating the TMs. POLAR overcomes these shortcomings by integrating TM arithmetic with \textbf{Bernstein B{\'e}zier Form} and \textbf{symbolic remainder}. The former enables TM propagation across non-differentiable activation functions and local refinement of TMs, and the latter reduces error accumulation in the TM remainder for linear mappings in the network. Experimental results show that POLAR significantly outperforms the current state-of-the-art tools in terms of both efficiency and tightness of the reachable set overapproximation. The source code can be found in https://github.com/ChaoHuang2018/POLAR_Tool

Large pre-trained generative models are known to occasionally output undesirable samples, which undermines their trustworthiness. The common way to mitigate this is to re-train them differently from scratch using different data or different regularization -- which uses a lot of computational resources and does not always fully address the problem. In this work, we take a different, more compute-friendly approach and investigate how to post-edit a model after training so that it ''redacts'', or refrains from outputting certain kinds of samples. We show that redaction is a fundamentally different task from data deletion, and data deletion may not always lead to redaction. We then consider Generative Adversarial Networks (GANs), and provide three different algorithms for data redaction that differ on how the samples to be redacted are described. Extensive evaluations on real-world image datasets show that our algorithms out-perform data deletion baselines, and are capable of redacting data while retaining high generation quality at a fraction of the cost of full re-training.

The Information Bottleneck theory provides a theoretical and computational framework for finding approximate minimum sufficient statistics. Analysis of the Stochastic Gradient Descent (SGD) training of a neural network on a toy problem has shown the existence of two phases, fitting and compression. In this work, we analyze the SGD training process of a Deep Neural Network on MNIST classification and confirm the existence of two phases of SGD training. We also propose a setup for estimating the mutual information for a Deep Neural Network through Variational Inference.

To increase the quality of citizens' lives, we designed a personalized smart chair system to recognize sitting behaviors. The system can receive surface pressure data from the designed sensor and provide feedback for guiding the user towards proper sitting postures. We used a liquid state machine and a logistic regression classifier to construct a spiking neural network for classifying 15 sitting postures. To allow this system to read our pressure data into the spiking neurons, we designed an algorithm to encode map-like data into cosine-rank sparsity data. The experimental results consisting of 15 sitting postures from 19 participants show that the prediction precision of our SNN is 88.52%.

Machine learning (ML) models can leak information about users, and differential privacy (DP) provides a rigorous way to bound that leakage under a given budget. This DP budget can be regarded as a new type of compute resource in workloads of multiple ML models training on user data. Once it is used, the DP budget is forever consumed. Therefore, it is crucial to allocate it most efficiently to train as many models as possible. This paper presents the scheduler for privacy that optimizes for efficiency. We formulate privacy scheduling as a new type of multidimensional knapsack problem, called privacy knapsack, which maximizes DP budget efficiency. We show that privacy knapsack is NP-hard, hence practical algorithms are necessarily approximate. We develop an approximation algorithm for privacy knapsack, DPK, and evaluate it on microbenchmarks and on a new, synthetic private-ML workload we developed from the Alibaba ML cluster trace. We show that DPK: (1) often approaches the efficiency-optimal schedule, (2) consistently schedules more tasks compared to a state-of-the-art privacy scheduling algorithm that focused on fairness (1.3-1.7x in Alibaba, 1.0-2.6x in microbenchmarks), but (3) sacrifices some level of fairness for efficiency. Therefore, using DPK, DP ML operators should be able to train more models on the same amount of user data while offering the same privacy guarantee to their users.

Despite its popularity in the reinforcement learning community, a provably convergent policy gradient method for continuous space-time control problems with nonlinear state dynamics has been elusive. This paper proposes proximal gradient algorithms for feedback controls of finite-time horizon stochastic control problems. The state dynamics are nonlinear diffusions with control-affine drift, and the cost functions are nonconvex in the state and nonsmooth in the control. The system noise can degenerate, which allows for deterministic control problems as special cases. We prove under suitable conditions that the algorithm converges linearly to a stationary point of the control problem, and is stable with respect to policy updates by approximate gradient steps. The convergence result justifies the recent reinforcement learning heuristics that adding entropy regularization or a fictitious discount factor to the optimization objective accelerates the convergence of policy gradient methods. The proof exploits careful regularity estimates of backward stochastic differential equations.

Quaternion valued neural networks experienced rising popularity and interest from researchers in the last years, whereby the derivatives with respect to quaternions needed for optimization are calculated as the sum of the partial derivatives with respect to the real and imaginary parts. However, we can show that product- and chain-rule does not hold with this approach. We solve this by employing the GHRCalculus and derive quaternion backpropagation based on this. Furthermore, we experimentally prove the functionality of the derived quaternion backpropagation.

Continual Learning is considered a key step toward next-generation Artificial Intelligence. Among various methods, replay-based approaches that maintain and replay a small episodic memory of previous samples are one of the most successful strategies against catastrophic forgetting. However, since forgetting is inevitable given bounded memory and unbounded tasks, how to forget is a problem continual learning must address. Therefore, beyond simply avoiding catastrophic forgetting, an under-explored issue is how to reasonably forget while ensuring the merits of human memory, including 1. storage efficiency, 2. generalizability, and 3. some interpretability. To achieve these simultaneously, our paper proposes a new saliency-augmented memory completion framework for continual learning, inspired by recent discoveries in memory completion separation in cognitive neuroscience. Specifically, we innovatively propose to store the part of the image most important to the tasks in episodic memory by saliency map extraction and memory encoding. When learning new tasks, previous data from memory are inpainted by an adaptive data generation module, which is inspired by how humans complete episodic memory. The module's parameters are shared across all tasks and it can be jointly trained with a continual learning classifier as bilevel optimization. Extensive experiments on several continual learning and image classification benchmarks demonstrate the proposed method's effectiveness and efficiency.

Machine learning methods have revolutionized the discovery process of new molecules and materials. However, the intensive training process of neural networks for molecules with ever-increasing complexity has resulted in exponential growth in computation cost, leading to long simulation time and high energy consumption. Photonic chip technology offers an alternative platform for implementing neural networks with faster data processing and lower energy usage compared to digital computers. Photonics technology is naturally capable of implementing complex-valued neural networks at no additional hardware cost. Here, we demonstrate the capability of photonic neural networks for predicting the quantum mechanical properties of molecules. To the best of our knowledge, this work is the first to harness photonic technology for machine learning applications in computational chemistry and molecular sciences, such as drug discovery and materials design. We further show that multiple properties can be learned simultaneously in a photonic chip via a multi-task regression learning algorithm, which is also the first of its kind as well, as most previous works focus on implementing a network in the classification task.

Latent factor model estimation typically relies on either using domain knowledge to manually pick several observed covariates as factor proxies, or purely conducting multivariate analysis such as principal component analysis. However, the former approach may suffer from the bias while the latter can not incorporate additional information. We propose to bridge these two approaches while allowing the number of factor proxies to diverge, and hence make the latent factor model estimation robust, flexible, and statistically more accurate. As a bonus, the number of factors is also allowed to grow. At the heart of our method is a penalized reduced rank regression to combine information. To further deal with heavy-tailed data, a computationally attractive penalized robust reduced rank regression method is proposed. We establish faster rates of convergence compared with the benchmark. Extensive simulations and real examples are used to illustrate the advantages.

How to learn an effective reinforcement learning-based model for control tasks from high-level visual observations is a practical and challenging problem. A key to solving this problem is to learn low-dimensional state representations from observations, from which an effective policy can be learned. In order to boost the learning of state encoding, recent works are focused on capturing behavioral similarities between state representations or applying data augmentation on visual observations. In this paper, we propose a novel meta-learner-based framework for representation learning regarding behavioral similarities for reinforcement learning. Specifically, our framework encodes the high-dimensional observations into two decomposed embeddings regarding reward and dynamics in a Markov Decision Process (MDP). A pair of meta-learners are developed, one of which quantifies the reward similarity and the other quantifies dynamics similarity over the correspondingly decomposed embeddings. The meta-learners are self-learned to update the state embeddings by approximating two disjoint terms in on-policy bisimulation metric. To incorporate the reward and dynamics terms, we further develop a strategy to adaptively balance their impacts based on different tasks or environments. We empirically demonstrate that our proposed framework outperforms state-of-the-art baselines on several benchmarks, including conventional DM Control Suite, Distracting DM Control Suite and a self-driving task CARLA.

Training agents via off-policy deep reinforcement learning (RL) requires a large memory, named replay memory, that stores past experiences used for learning. These experiences are sampled, uniformly or non-uniformly, to create the batches used for training. When calculating the loss function, off-policy algorithms assume that all samples are of the same importance. In this paper, we hypothesize that training can be enhanced by assigning different importance for each experience based on their temporal-difference (TD) error directly in the training objective. We propose a novel method that introduces a weighting factor for each experience when calculating the loss function at the learning stage. In addition to improving convergence speed when used with uniform sampling, the method can be combined with prioritization methods for non-uniform sampling. Combining the proposed method with prioritization methods improves sampling efficiency while increasing the performance of TD-based off-policy RL algorithms. The effectiveness of the proposed method is demonstrated by experiments in six environments of the OpenAI Gym suite. The experimental results demonstrate that the proposed method achieves a 33%~76% reduction of convergence speed in three environments and an 11% increase in returns and a 3%~10% increase in success rate for other three environments.

Stroke is known as a major global health problem, and for stroke survivors it is key to monitor the recovery levels. However, traditional stroke rehabilitation assessment methods (such as the popular clinical assessment) can be subjective and expensive, and it is also less convenient for patients to visit clinics in a high frequency. To address this issue, in this work based on wearable sensing and machine learning techniques, we develop an automated system that can predict the assessment score in an objective manner. With wrist-worn sensors, accelerometer data is collected from 59 stroke survivors in free-living environments for a duration of 8 weeks, and we map the week-wise accelerometer data(3 days per week) to the assessment score by developing signal processing and predictive model pipeline. To achieve this, we propose two types of new features, which can encode the rehabilitation information from both paralysed and non-paralysed sides while suppressing the high level noises such as irrelevant daily activities. Based on the proposed features, we further develop the longitudinal mixed-effects model with Gaussian process prior (LMGP), which can model the random effects caused by different subjects and time slots (during the 8 weeks). Comprehensive experiments are conducted to evaluate our system on both acute and chronic patients, and the promising results suggest its effectiveness.

Urban traffic speed prediction aims to estimate the future traffic speed for improving the urban transportation services. Enormous efforts have been made on exploiting spatial correlations and temporal dependencies of traffic speed evolving patterns by leveraging explicit spatial relations (geographical proximity) through pre-defined geographical structures ({\it e.g.}, region grids or road networks). While achieving promising results, current traffic speed prediction methods still suffer from ignoring implicit spatial correlations (interactions), which cannot be captured by grid/graph convolutions. To tackle the challenge, we propose a generic model for enabling the current traffic speed prediction methods to preserve implicit spatial correlations. Specifically, we first develop a Dual-Transformer architecture, including a Spatial Transformer and a Temporal Transformer. The Spatial Transformer automatically learns the implicit spatial correlations across the road segments beyond the boundary of geographical structures, while the Temporal Transformer aims to capture the dynamic changing patterns of the implicit spatial correlations. Then, to further integrate both explicit and implicit spatial correlations, we propose a distillation-style learning framework, in which the existing traffic speed prediction methods are considered as the teacher model, and the proposed Dual-Transformer architectures are considered as the student model. The extensive experiments over three real-world datasets indicate significant improvements of our proposed framework over the existing methods.

Representing crystal structures of materials to facilitate determining them via neural networks is crucial for enabling machine-learning applications involving crystal structure estimation. Among these applications, the inverse design of materials can contribute to next-generation methods that explore materials with desired properties without relying on luck or serendipity. We propose neural structure fields (NeSF) as an accurate and practical approach for representing crystal structures using neural networks. Inspired by the concepts of vector fields in physics and implicit neural representations in computer vision, the proposed NeSF considers a crystal structure as a continuous field rather than as a discrete set of atoms. Unlike existing grid-based discretized spatial representations, the NeSF overcomes the tradeoff between spatial resolution and computational complexity and can represent any crystal structure. To evaluate the NeSF, we propose an autoencoder of crystal structures that can recover various crystal structures, such as those of perovskite structure materials and cuprate superconductors. Extensive quantitative results demonstrate the superior performance of the NeSF compared with the existing grid-based approach.

Neoplasms (NPs) and neurological diseases and disorders (NDDs) are amongst the major classes of diseases underlying deaths of a disproportionate number of people worldwide. To determine if there exist some distinctive features in the local wiring patterns of protein interactions emerging at the onset of a disease belonging to either of these two classes, we examined 112 and 175 protein interaction networks belonging to NPs and NDDs, respectively. Orbit usage profiles (OUPs) for each of these networks were enumerated by investigating the networks' local topology. 56 non-redundant OUPs (nrOUPs) were derived and used as network features for classification between these two disease classes. Four machine learning classifiers, namely, k-nearest neighbour (KNN), support vector machine (SVM), deep neural network (DNN), random forest (RF) were trained on these data. DNN obtained the greatest average AUPRC (0.988) among these classifiers. DNNs developed on node2vec and the proposed nrOUPs embeddings were compared using 5-fold cross validation on the basis of average values of the six of performance measures, viz., AUPRC, Accuracy, Sensitivity, Specificity, Precision and MCC. It was found that nrOUPs based classifier performed better in all of these six performance measures.

In this paper, we propose a new neural network architecture based on the H2 matrix. Even though networks with H2-inspired architecture already exist, and our approach is designed to reduce memory costs and improve performance by taking into account the sparsity template of the H2 matrix. In numerical comparison with alternative neural networks, including the known H2-based ones, our architecture showed itself as beneficial in terms of performance, memory, and scalability.

Object detection models commonly deployed on uncrewed aerial systems (UAS) focus on identifying objects in the visible spectrum using Red-Green-Blue (RGB) imagery. However, there is growing interest in fusing RGB with thermal long wave infrared (LWIR) images to increase the performance of object detection machine learning (ML) models. Currently LWIR ML models have received less research attention, especially for both ground- and air-based platforms, leading to a lack of baseline performance metrics evaluating LWIR, RGB and LWIR-RGB fused object detection models. Therefore, this research contributes such quantitative metrics to the literature .The results found that the ground-based blended RGB-LWIR model exhibited superior performance compared to the RGB or LWIR approaches, achieving a mAP of 98.4%. Additionally, the blended RGB-LWIR model was also the only object detection model to work in both day and night conditions, providing superior operational capabilities. This research additionally contributes a novel labelled training dataset of 12,600 images for RGB, LWIR, and RGB-LWIR fused imagery, collected from ground-based and air-based platforms, enabling further multispectral machine-driven object detection research.

In this paper, we improve the kernel alignment regret bound for online kernel learning in the regime of the Hinge loss function. Previous algorithm achieves a regret of $O((\mathcal{A}_TT\ln{T})^{\frac{1}{4}})$ at a computational complexity (space and per-round time) of $O(\sqrt{\mathcal{A}_TT\ln{T}})$, where $\mathcal{A}_T$ is called \textit{kernel alignment}. We propose an algorithm whose regret bound and computational complexity are better than previous results. Our results depend on the decay rate of eigenvalues of the kernel matrix. If the eigenvalues of the kernel matrix decay exponentially, then our algorithm enjoys a regret of $O(\sqrt{\mathcal{A}_T})$ at a computational complexity of $O(\ln^2{T})$. Otherwise, our algorithm enjoys a regret of $O((\mathcal{A}_TT)^{\frac{1}{4}})$ at a computational complexity of $O(\sqrt{\mathcal{A}_TT})$. We extend our algorithm to batch learning and obtain a $O(\frac{1}{T}\sqrt{\mathbb{E}[\mathcal{A}_T]})$ excess risk bound which improves the previous $O(1/\sqrt{T})$ bound.

The Coronavirus disease 2019 (COVID-19) was first identified in Wuhan, China, in early December 2019 and now becoming a pandemic. When COVID-19 patients undergo radiography examination, radiologists can observe the present of radiographic abnormalities from their chest X-ray (CXR) images. In this study, a deep convolutional neural network (CNN) model was proposed to aid radiologists in diagnosing COVID-19 patients. First, this work conducted a comparative study on the performance of modified VGG-16, ResNet-50 and DenseNet-121 to classify CXR images into normal, COVID-19 and viral pneumonia. Then, the impact of image augmentation on the classification results was evaluated. The publicly available COVID-19 Radiography Database was used throughout this study. After comparison, ResNet-50 achieved the highest accuracy with 95.88%. Next, after training ResNet-50 with rotation, translation, horizontal flip, intensity shift and zoom augmented dataset, the accuracy dropped to 80.95%. Furthermore, an ablation study on the effect of image augmentation on the classification results found that the combinations of rotation and intensity shift augmentation methods obtained an accuracy higher than baseline, which is 96.14%. Finally, ResNet-50 with rotation and intensity shift augmentations performed the best and was proposed as the final classification model in this work. These findings demonstrated that the proposed classification model can provide a promising result for COVID-19 diagnosis.

Graph neural networks (GNN) have become the default machine learning model for relational datasets, including protein interaction networks, biological neural networks, and scientific collaboration graphs. We use tools from statistical physics and random matrix theory to precisely characterize generalization in simple graph convolution networks on the contextual stochastic block model. The derived curves are phenomenologically rich: they explain the distinction between learning on homophilic and heterophilic graphs and they predict double descent whose existence in GNNs has been questioned by recent work. Our results are the first to accurately explain the behavior not only of a stylized graph learning model but also of complex GNNs on messy real-world datasets. To wit, we use our analytic insights about homophily and heterophily to improve performance of state-of-the-art graph neural networks on several heterophilic benchmarks by a simple addition of negative self-loop filters.

Human Activity Recognition (HAR) is an emerging technology with several applications in surveillance, security, and healthcare sectors. Noninvasive HAR systems based on Wi-Fi Channel State Information (CSI) signals can be developed leveraging the quick growth of ubiquitous Wi-Fi technologies, and the correlation between CSI dynamics and body motions. In this paper, we propose Principal Component-based Wavelet Convolutional Neural Network (or PCWCNN) -- a novel approach that offers robustness and efficiency for practical real-time applications. Our proposed method incorporates two efficient preprocessing algorithms -- the Principal Component Analysis (PCA) and the Discrete Wavelet Transform (DWT). We employ an adaptive activity segmentation algorithm that is accurate and computationally light. Additionally, we used the Wavelet CNN for classification, which is a deep convolutional network analogous to the well-studied ResNet and DenseNet networks. We empirically show that our proposed PCWCNN model performs very well on a real dataset, outperforming existing approaches.

The primary goal of this work is to study the effectiveness of an unsupervised domain adaptation approach for various applications such as binary classification and anomaly detection in the context of Alzheimer's disease (AD) detection for the OASIS datasets. We also explore image reconstruction and image synthesis for analyzing and generating 3D structural MRI data to establish performance benchmarks for anomaly detection. We successfully demonstrate that domain adaptation improves the performance of AD detection when implemented in both supervised and unsupervised settings. Additionally, the proposed methodology achieves state-of-the-art performance for binary classification on the OASIS-1 dataset.

We study the problem of learning the objective functions or constraints of a multiobjective decision making model, based on a set of sequentially arrived decisions. In particular, these decisions might not be exact and possibly carry measurement noise or are generated with the bounded rationality of decision makers. In this paper, we propose a general online learning framework to deal with this learning problem using inverse multiobjective optimization. More precisely, we develop two online learning algorithms with implicit update rules which can handle noisy data. Numerical results show that both algorithms can learn the parameters with great accuracy and are robust to noise.

Accurate modeling of ship performance is crucial for the shipping industry to optimize fuel consumption and subsequently reduce emissions. However, predicting the speed-power relation in real-world conditions remains a challenge. In this study, we used in-service monitoring data from multiple vessels with different hull shapes to compare the accuracy of data-driven machine learning (ML) algorithms to traditional methods for assessing ship performance. Our analysis consists of two main parts: (1) a comparison of sea trial curves with calm-water curves fitted on operational data, and (2) a benchmark of multiple added wave resistance theories with an ML-based approach. Our results showed that a simple neural network outperformed established semi-empirical formulas following first principles. The neural network only required operational data as input, while the traditional methods required extensive ship particulars that are often unavailable. These findings suggest that data-driven algorithms may be more effective for predicting ship performance in practical applications.

Nonconvex-nonconcave minimax optimization has been the focus of intense research over the last decade due to its broad applications in machine learning and operation research. Unfortunately, most existing algorithms cannot be guaranteed to converge and always suffer from limit cycles. Their global convergence relies on certain conditions that are difficult to check, including but not limited to the global Polyak-\L{}ojasiewicz condition, the existence of a solution satisfying the weak Minty variational inequality and $\alpha$-interaction dominant condition. In this paper, we develop the first provably convergent algorithm called doubly smoothed gradient descent ascent method, which gets rid of the limit cycle without requiring any additional conditions. We further show that the algorithm has an iteration complexity of $\mathcal{O}(\epsilon^{-4})$ for finding a game stationary point, which matches the best iteration complexity of single-loop algorithms under nonconcave-concave settings. The algorithm presented here opens up a new path for designing provable algorithms for nonconvex-nonconcave minimax optimization problems.

We propose a neural network-based model for nonlinear dynamics in continuous time that can impose inductive biases on decay rates and/or frequencies. Inductive biases are helpful for training neural networks especially when training data are small. The proposed model is based on the Koopman operator theory, where the decay rate and frequency information is used by restricting the eigenvalues of the Koopman operator that describe linear evolution in a Koopman space. We use neural networks to find an appropriate Koopman space, which are trained by minimizing multi-step forecasting and backcasting errors using irregularly sampled time-series data. Experiments on various time-series datasets demonstrate that the proposed method achieves higher forecasting performance given a single short training sequence than the existing methods.

Much of the information of breathing is contained within the photoplethysmography (PPG) signal, through changes in venous blood flow, heart rate and stroke volume. We aim to leverage this fact, by employing a novel deep learning framework which is a based on a repurposed convolutional autoencoder. Our model aims to encode all of the relevant respiratory information contained within photoplethysmography waveform, and decode it into a waveform that is similar to a gold standard respiratory reference. The model is employed on two photoplethysmography data sets, namely Capnobase and BIDMC. We show that the model is capable of producing respiratory waveforms that approach the gold standard, while in turn producing state of the art respiratory rate estimates. We also show that when it comes to capturing more advanced respiratory waveform characteristics such as duty cycle, our model is for the most part unsuccessful. A suggested reason for this, in light of a previous study on in-ear PPG, is that the respiratory variations in finger-PPG are far weaker compared with other recording locations. Importantly, our model can perform these waveform estimates in a fraction of a millisecond, giving it the capacity to produce over 6 hours of respiratory waveforms in a single second. Moreover, we attempt to interpret the behaviour of the kernel weights within the model, showing that in part our model intuitively selects different breathing frequencies. The model proposed in this work could help to improve the usefulness of consumer PPG-based wearables for medical applications, where detailed respiratory information is required.

Unlike tabular data, features in network data are interconnected within a domain-specific graph. Examples of this setting include gene expression overlaid on a protein interaction network (PPI) and user opinions in a social network. Network data is typically high-dimensional (large number of nodes) and often contains outlier snapshot instances and noise. In addition, it is often non-trivial and time-consuming to annotate instances with global labels (e.g., disease or normal). How can we jointly select discriminative subnetworks and representative instances for network data without supervision? We address these challenges within an unsupervised framework for joint subnetwork and instance selection in network data, called UISS, via a convex self-representation objective. Given an unlabeled network dataset, UISS identifies representative instances while ignoring outliers. It outperforms state-of-the-art baselines on both discriminative subnetwork selection and representative instance selection, achieving up to 10% accuracy improvement on all real-world data sets we use for evaluation. When employed for exploratory analysis in RNA-seq network samples from multiple studies it produces interpretable and informative summaries.

Name ambiguity is common in academic digital libraries, such as multiple authors having the same name. This creates challenges for academic data management and analysis, thus name disambiguation becomes necessary. The procedure of name disambiguation is to divide publications with the same name into different groups, each group belonging to a unique author. A large amount of attribute information in publications makes traditional methods fall into the quagmire of feature selection. These methods always select attributes artificially and equally, which usually causes a negative impact on accuracy. The proposed method is mainly based on representation learning for heterogeneous networks and clustering and exploits the self-attention technology to solve the problem. The presentation of publications is a synthesis of structural and semantic representations. The structural representation is obtained by meta-path-based sampling and a skip-gram-based embedding method, and meta-path level attention is introduced to automatically learn the weight of each feature. The semantic representation is generated using NLP tools. Our proposal performs better in terms of name disambiguation accuracy compared with baselines and the ablation experiments demonstrate the improvement by feature selection and the meta-path level attention in our method. The experimental results show the superiority of our new method for capturing the most attributes from publications and reducing the impact of redundant information.

Kernel machines have sustained continuous progress in the field of quantum chemistry. In particular, they have proven to be successful in the low-data regime of force field reconstruction. This is because many physical invariances and symmetries can be incorporated into the kernel function to compensate for much larger datasets. So far, the scalability of this approach has however been hindered by its cubical runtime in the number of training points. While it is known, that iterative Krylov subspace solvers can overcome these burdens, they crucially rely on effective preconditioners, which are elusive in practice. Practical preconditioners need to be computationally efficient and numerically robust at the same time. Here, we consider the broad class of Nystr\"om-type methods to construct preconditioners based on successively more sophisticated low-rank approximations of the original kernel matrix, each of which provides a different set of computational trade-offs. All considered methods estimate the relevant subspace spanned by the kernel matrix columns using different strategies to identify a representative set of inducing points. Our comprehensive study covers the full spectrum of approaches, starting from naive random sampling to leverage score estimates and incomplete Cholesky factorizations, up to exact SVD decompositions.

Traffic flow prediction is an important part of smart transportation. The goal is to predict future traffic conditions based on historical data recorded by sensors and the traffic network. As the city continues to build, parts of the transportation network will be added or modified. How to accurately predict expanding and evolving long-term streaming networks is of great significance. To this end, we propose a new simulation-based criterion that considers teaching autonomous agents to mimic sensor patterns, planning their next visit based on the sensor's profile (e.g., traffic, speed, occupancy). The data recorded by the sensor is most accurate when the agent can perfectly simulate the sensor's activity pattern. We propose to formulate the problem as a continuous reinforcement learning task, where the agent is the next flow value predictor, the action is the next time-series flow value in the sensor, and the environment state is a dynamically fused representation of the sensor and transportation network. Actions taken by the agent change the environment, which in turn forces the agent's mode to update, while the agent further explores changes in the dynamic traffic network, which helps the agent predict its next visit more accurately. Therefore, we develop a strategy in which sensors and traffic networks update each other and incorporate temporal context to quantify state representations evolving over time.

Data-centric AI is at the center of a fundamental shift in software engineering where machine learning becomes the new software, powered by big data and computing infrastructure. Here software engineering needs to be re-thought where data becomes a first-class citizen on par with code. One striking observation is that a significant portion of the machine learning process is spent on data preparation. Without good data, even the best machine learning algorithms cannot perform well. As a result, data-centric AI practices are now becoming mainstream. Unfortunately, many datasets in the real world are small, dirty, biased, and even poisoned. In this survey, we study the research landscape for data collection and data quality primarily for deep learning applications. Data collection is important because there is lesser need for feature engineering for recent deep learning approaches, but instead more need for large amounts of data. For data quality, we study data validation, cleaning, and integration techniques. Even if the data cannot be fully cleaned, we can still cope with imperfect data during model training using robust model training techniques. In addition, while bias and fairness have been less studied in traditional data management research, these issues become essential topics in modern machine learning applications. We thus study fairness measures and unfairness mitigation techniques that can be applied before, during, or after model training. We believe that the data management community is well poised to solve these problems.

Estimating the state of charge (SOC) of compound energy storage devices in the hybrid energy storage system (HESS) of electric vehicles (EVs) is vital in improving the performance of the EV. The complex and variable charging and discharging current of EVs makes an accurate SOC estimation a challenge. This paper proposes a novel deep learning-based SOC estimation method for lithium-ion battery-supercapacitor HESS EV based on the nonlinear autoregressive with exogenous inputs neural network (NARXNN). The NARXNN is utilized to capture and overcome the complex nonlinear behaviors of lithium-ion batteries and supercapacitors in EVs. The results show that the proposed method improved the SOC estimation accuracy by 91.5% on average with error values below 0.1% and reduced consumption time by 11.4%. Hence validating both the effectiveness and robustness of the proposed method.

At the core of insurance business lies classification between risky and non-risky insureds, actuarial fairness meaning that risky insureds should contribute more and pay a higher premium than non-risky or less-risky ones. Actuaries, therefore, use econometric or machine learning techniques to classify, but the distinction between a fair actuarial classification and "discrimination" is subtle. For this reason, there is a growing interest about fairness and discrimination in the actuarial community Lindholm, Richman, Tsanakas, and Wuthrich (2022). Presumably, non-sensitive characteristics can serve as substitutes or proxies for protected attributes. For example, the color and model of a car, combined with the driver's occupation, may lead to an undesirable gender bias in the prediction of car insurance prices. Surprisingly, we will show that debiasing the predictor alone may be insufficient to maintain adequate accuracy (1). Indeed, the traditional pricing model is currently built in a two-stage structure that considers many potentially biased components such as car or geographic risks. We will show that this traditional structure has significant limitations in achieving fairness. For this reason, we have developed a novel pricing model approach. Recently some approaches have Blier-Wong, Cossette, Lamontagne, and Marceau (2021); Wuthrich and Merz (2021) shown the value of autoencoders in pricing. In this paper, we will show that (2) this can be generalized to multiple pricing factors (geographic, car type), (3) it perfectly adapted for a fairness context (since it allows to debias the set of pricing components): We extend this main idea to a general framework in which a single whole pricing model is trained by generating the geographic and car pricing components needed to predict the pure premium while mitigating the unwanted bias according to the desired metric.

We present a unified hard-constraint framework for solving geometrically complex PDEs with neural networks, where the most commonly used Dirichlet, Neumann, and Robin boundary conditions (BCs) are considered. Specifically, we first introduce the "extra fields" from the mixed finite element method to reformulate the PDEs so as to equivalently transform the three types of BCs into linear forms. Based on the reformulation, we derive the general solutions of the BCs analytically, which are employed to construct an ansatz that automatically satisfies the BCs. With such a framework, we can train the neural networks without adding extra loss terms and thus efficiently handle geometrically complex PDEs, alleviating the unbalanced competition between the loss terms corresponding to the BCs and PDEs. We theoretically demonstrate that the "extra fields" can stabilize the training process. Experimental results on real-world geometrically complex PDEs showcase the effectiveness of our method compared with state-of-the-art baselines.

Theoretically, the conditional expectation of a square-integrable random variable $Y$ given a $d$-dimensional random vector $X$ can be obtained by minimizing the mean squared distance between $Y$ and $f(X)$ over all Borel measurable functions $f \colon \mathbb{R}^d \to \mathbb{R}$. However, in many applications this minimization problem cannot be solved exactly, and instead, a numerical method which computes an approximate minimum over a suitable subfamily of Borel functions has to be used. The quality of the result depends on the adequacy of the subfamily and the performance of the numerical method. In this paper, we derive an expected value representation of the minimal mean squared distance which in many applications can efficiently be approximated with a standard Monte Carlo average. This enables us to provide guarantees for the accuracy of any numerical approximation of a given conditional expectation. We illustrate the method by assessing the quality of approximate conditional expectations obtained by linear, polynomial and neural network regression in different concrete examples.

In this work, we propose a novel framework for estimating the dimension of the data manifold using a trained diffusion model. A trained diffusion model approximates the gradient of the log density of a noise-corrupted version of the target distribution for varying levels of corruption. If the data concentrates around a manifold embedded in the high-dimensional ambient space, then as the level of corruption decreases, the score function points towards the manifold, as this direction becomes the direction of maximum likelihood increase. Therefore, for small levels of corruption, the diffusion model provides us with access to an approximation of the normal bundle of the data manifold. This allows us to estimate the dimension of the tangent space, thus, the intrinsic dimension of the data manifold. Our method outperforms linear methods for dimensionality detection such as PPCA in controlled experiments.

Lifelong language learning aims to stream learning NLP tasks while retaining knowledge of previous tasks. Previous works based on the language model and following data-free constraint approaches have explored formatting all data as "begin token (\textit{B}) + context (\textit{C}) + question (\textit{Q}) + answer (\textit{A})" for different tasks. However, they still suffer from catastrophic forgetting and are exacerbated when the previous task's pseudo data is insufficient for the following reasons: (1) The model has difficulty generating task-corresponding pseudo data, and (2) \textit{A} is prone to error when \textit{A} and \textit{C} are separated by \textit{Q} because the information of the \textit{C} is diminished before generating \textit{A}. Therefore, we propose the Ask Question First and Replay Question (AQF-RQ), including a novel data format "\textit{BQCA}" and a new training task to train pseudo questions of previous tasks. Experimental results demonstrate that AQF-RQ makes it easier for the model to generate more pseudo data that match corresponding tasks, and is more robust to both sufficient and insufficient pseudo-data when the task boundary is both clear and unclear. AQF-RQ can achieve only 0.36\% lower performance than multi-task learning.

A canonical algorithm for log-concave sampling is the Langevin Algorithm, aka the Langevin Diffusion run with some discretization stepsize $\eta > 0$. This discretization leads the Langevin Algorithm to have a stationary distribution $\pi_{\eta}$ which differs from the stationary distribution $\pi$ of the Langevin Diffusion, and it is an important challenge to understand whether the well-known properties of $\pi$ extend to $\pi_{\eta}$. In particular, while concentration properties such as isoperimetry and rapidly decaying tails are classically known for $\pi$, the analogous properties for $\pi_{\eta}$ are open questions with direct algorithmic implications. This note provides a first step in this direction by establishing concentration results for $\pi_{\eta}$ that mirror classical results for $\pi$. Specifically, we show that for any nontrivial stepsize $\eta > 0$, $\pi_{\eta}$ is sub-exponential (respectively, sub-Gaussian) when the potential is convex (respectively, strongly convex). Moreover, the concentration bounds we show are essentially tight. Key to our analysis is the use of a rotation-invariant moment generating function (aka Bessel function) to study the stationary dynamics of the Langevin Algorithm. This technique may be of independent interest because it enables directly analyzing the discrete-time stationary distribution $\pi_{\eta}$ without going through the continuous-time stationary distribution $\pi$ as an intermediary.

Remote state estimation of large-scale distributed dynamic processes plays an important role in Industry 4.0 applications. In this paper, we focus on the transmission scheduling problem of a remote estimation system. First, we derive some structural properties of the optimal sensor scheduling policy over fading channels. Then, building on these theoretical guidelines, we develop a structure-enhanced deep reinforcement learning (DRL) framework for optimal scheduling of the system to achieve the minimum overall estimation mean-square error (MSE). In particular, we propose a structure-enhanced action selection method, which tends to select actions that obey the policy structure. This explores the action space more effectively and enhances the learning efficiency of DRL agents. Furthermore, we introduce a structure-enhanced loss function to add penalties to actions that do not follow the policy structure. The new loss function guides the DRL to converge to the optimal policy structure quickly. Our numerical experiments illustrate that the proposed structure-enhanced DRL algorithms can save the training time by 50% and reduce the remote estimation MSE by 10% to 25% when compared to benchmark DRL algorithms. In addition, we show that the derived structural properties exist in a wide range of dynamic scheduling problems that go beyond remote state estimation.

The task of out-of-distribution (OOD) detection is vital to realize safe and reliable operation for real-world applications. After the failure of likelihood-based detection in high dimensions had been shown, approaches based on the \emph{typical set} have been attracting attention; however, they still have not achieved satisfactory performance. Beginning by presenting the failure case of the typicality-based approach, we propose a new reconstruction error-based approach that employs normalizing flow (NF). We further introduce a typicality-based penalty, and by incorporating it into the reconstruction error in NF, we propose a new OOD detection method, penalized reconstruction error (PRE). Because the PRE detects test inputs that lie off the in-distribution manifold, it effectively detects adversarial examples as well as OOD examples. We show the effectiveness of our method through the evaluation using natural image datasets, CIFAR-10, TinyImageNet, and ILSVRC2012.

Virtual Adversarial Training (VAT) has shown impressive results among recently developed regularization methods called consistency regularization. VAT utilizes adversarial samples, generated by injecting perturbation in the input space, for training and thereby enhances the generalization ability of a classifier. However, such adversarial samples can be generated only within a very small area around the input data point, which limits the adversarial effectiveness of such samples. To address this problem we propose LVAT (Latent space VAT), which injects perturbation in the latent space instead of the input space. LVAT can generate adversarial samples flexibly, resulting in more adverse effects and thus more effective regularization. The latent space is built by a generative model, and in this paper, we examine two different type of models: variational auto-encoder and normalizing flow, specifically Glow. We evaluated the performance of our method in both supervised and semi-supervised learning scenarios for an image classification task using SVHN and CIFAR-10 datasets. In our evaluation, we found that our method outperforms VAT and other state-of-the-art methods.

In order for artificial neural networks to begin accurately mimicking biological ones, they must be able to adapt to new exigencies without forgetting what they have learned from previous training. Lifelong learning approaches to artificial neural networks attempt to strive towards this goal, yet have not progressed far enough to be realistically deployed for natural language processing tasks. The proverbial roadblock of catastrophic forgetting still gate-keeps researchers from an adequate lifelong learning model. While efforts are being made to quell catastrophic forgetting, there is a lack of research that looks into the importance of class ordering when training on new classes for incremental learning. This is surprising as the ordering of "classes" that humans learn is heavily monitored and incredibly important. While heuristics to develop an ideal class order have been researched, this paper examines class ordering as it relates to priming as a scheme for incremental class learning. By examining the connections between various methods of priming found in humans and how those are mimicked yet remain unexplained in life-long machine learning, this paper provides a better understanding of the similarities between our biological systems and the synthetic systems while simultaneously improving current practices to combat catastrophic forgetting. Through the merging of psychological priming practices with class ordering, this paper is able to identify a generalizable method for class ordering in NLP incremental learning tasks that consistently outperforms random class ordering.

High-dimensional data arises in numerous applications, and the rapidly developing field of geometric deep learning seeks to develop neural network architectures to analyze such data in non-Euclidean domains, such as graphs and manifolds. Recent work by Z. Wang, L. Ruiz, and A. Ribeiro has introduced a method for constructing manifold neural networks using the spectral decomposition of the Laplace Beltrami operator. Moreover, in this work, the authors provide a numerical scheme for implementing such neural networks when the manifold is unknown and one only has access to finitely many sample points. The authors show that this scheme, which relies upon building a data-driven graph, converges to the continuum limit as the number of sample points tends to infinity. Here, we build upon this result by establishing a rate of convergence that depends on the intrinsic dimension of the manifold but is independent of the ambient dimension. We also discuss how the rate of convergence depends on the depth of the network and the number of filters used in each layer.

A general, {\em rectangular} kernel matrix may be defined as $K_{ij} = \kappa(x_i,y_j)$ where $\kappa(x,y)$ is a kernel function and where $X=\{x_i\}_{i=1}^m$ and $Y=\{y_i\}_{i=1}^n$ are two sets of points. In this paper, we seek a low-rank approximation to a kernel matrix where the sets of points $X$ and $Y$ are large and are not well-separated (e.g., the points in $X$ and $Y$ may be ``intermingled''). Such rectangular kernel matrices may arise, for example, in Gaussian process regression where $X$ corresponds to the training data and $Y$ corresponds to the test data. In this case, the points are often high-dimensional. Since the point sets are large, we must exploit the fact that the matrix arises from a kernel function, and avoid forming the matrix, and thus ruling out most algebraic techniques. In particular, we seek methods that can scale linearly, i.e., with computational complexity $O(m)$ or $O(n)$ for a fixed accuracy or rank. The main idea in this paper is to {\em geometrically} select appropriate subsets of points to construct a low rank approximation. An analysis in this paper guides how this selection should be performed.

Our situated environment is full of uncertainty and highly dynamic, thus hindering the widespread adoption of machine-led Intelligent Decision-Making (IDM) in real world scenarios. This means IDM should have the capability of continuously learning new skills and efficiently generalizing across wider applications. IDM benefits from any new approaches and theoretical breakthroughs that exhibit Artificial General Intelligence (AGI) breaking the barriers between tasks and applications. Recent research has well-examined neural architecture, Transformer, as a backbone foundation model and its generalization to various tasks, including computer vision, natural language processing, and reinforcement learning. We therefore argue that a foundation decision model (FDM) can be established by formulating various decision-making tasks as a sequence decoding task using the Transformer architecture; this would be a promising solution to advance the applications of IDM in more complex real world tasks. In this paper, we elaborate on how a foundation decision model improves the efficiency and generalization of IDM. We also discuss potential applications of a FDM in multi-agent game AI, production scheduling, and robotics tasks. Finally, through a case study, we demonstrate our realization of the FDM, DigitalBrain (DB1) with 1.2 billion parameters, which achieves human-level performance over 453 tasks, including text generation, images caption, video games playing, robotic control, and traveling salesman problems. As a foundation decision model, DB1 would be a baby step towards more autonomous and efficient real world IDM applications.

Background and objective: Parotid gland tumors account for approximately 2% to 10% of head and neck tumors. Preoperative tumor localization, differential diagnosis, and subsequent selection of appropriate treatment for parotid gland tumors are critical. However, the relative rarity of these tumors and the highly dispersed tissue types have left an unmet need for a subtle differential diagnosis of such neoplastic lesions based on preoperative radiomics. Recently, deep learning methods have developed rapidly, especially Transformer beats the traditional convolutional neural network in computer vision. Many new Transformer-based networks have been proposed for computer vision tasks. Methods: In this study, multicenter multimodal parotid gland MR images were collected. The Swin-Unet which was based on Transformer was used. MR images of short time inversion recovery, T1-weighted and T2-weighted modalities were combined into three-channel data to train the network. We achieved segmentation of the region of interest for parotid gland and tumor. Results: The Dice-Similarity Coefficient of the model on the test set was 88.63%, Mean Pixel Accuracy was 99.31%, Mean Intersection over Union was 83.99%, and Hausdorff Distance was 3.04. Then a series of comparison experiments were designed in this paper to further validate the segmentation performance of the algorithm. Conclusions: Experimental results showed that our method has good results for parotid gland and tumor segmentation. The Transformer-based network outperforms the traditional convolutional neural network in the field of medical images.

Neurally-parameterized Structural Causal Models in the Pearlian notion to causality, referred to as NCM, were recently introduced as a step towards next-generation learning systems. However, said NCM are only concerned with the learning aspect of causal inference but totally miss out on the architecture aspect. That is, actual causal inference within NCM is intractable in that the NCM won't return an answer to a query in polynomial time. This insight follows as corollary to the more general statement on the intractability of arbitrary SCM parameterizations, which we prove in this work through classical 3-SAT reduction. Since future learning algorithms will be required to deal with both high dimensional data and highly complex mechanisms governing the data, we ultimately believe work on tractable inference for causality to be decisive. We also show that not all ``causal'' models are created equal. More specifically, there are models capable of answering causal queries that are not SCM, which we refer to as \emph{partially causal models} (PCM). We provide a tabular taxonomy in terms of tractability properties for all of the different model families, namely correlation-based, PCM and SCM. To conclude our work, we also provide some initial ideas on how to overcome parts of the intractability of causal inference with SCM by showing an example of how parameterizing an SCM with SPN modules can at least allow for tractable mechanisms. We hope that our impossibility result alongside the taxonomy for tractability in causal models can raise awareness for this novel research direction since achieving success with causality in real world downstream tasks will not only depend on learning correct models as we also require having the practical ability to gain access to model inferences.

Ultra-reliable short-packet communication is a major challenge in future wireless networks with critical applications. To achieve ultra-reliable communications beyond 99.999%, this paper envisions a new interaction-based communication paradigm that exploits feedback from the receiver. We present AttentionCode, a new class of feedback codes leveraging deep learning (DL) technologies. The underpinnings of AttentionCode are three architectural innovations: AttentionNet, input restructuring, and adaptation to fading channels, accompanied by several training methods, including large-batch training, distributed learning, look-ahead optimizer, training-test signal-to-noise ratio (SNR) mismatch, and curriculum learning. The training methods can potentially be generalized to other wireless communication applications with machine learning. Numerical experiments verify that AttentionCode establishes a new state of the art among all DL-based feedback codes in both additive white Gaussian noise (AWGN) channels and fading channels. In AWGN channels with noiseless feedback, for example, AttentionCode achieves a block error rate (BLER) of $10^{-7}$ when the forward channel SNR is 0 dB for a block size of 50 bits, demonstrating the potential of AttentionCode to provide ultra-reliable short-packet communications.

In this paper, we present a simple yet effective method (ABSGD) for addressing the data imbalance issue in deep learning. Our method is a simple modification to momentum SGD where we leverage an attentional mechanism to assign an individual importance weight to each gradient in the mini-batch. Unlike many existing heuristic-driven methods for tackling data imbalance, our method is grounded in {\it theoretically justified distributionally robust optimization (DRO)}, which is guaranteed to converge to a stationary point of an information-regularized DRO problem. The individual-level weight of a sampled data is systematically proportional to the exponential of a scaled loss value of the data, where the scaling factor is interpreted as the regularization parameter in the framework of information-regularized DRO. Compared with existing class-level weighting schemes, our method can capture the diversity between individual examples within each class. Compared with existing individual-level weighting methods using meta-learning that require three backward propagations for computing mini-batch stochastic gradients, our method is more efficient with only one backward propagation at each iteration as in standard deep learning methods. To balance between the learning of feature extraction layers and the learning of the classifier layer, we employ a two-stage method that uses SGD for pretraining followed by ABSGD for learning a robust classifier and finetuning lower layers. Our empirical studies on several benchmark datasets demonstrate the effectiveness of the proposed method.

Graph Neural Networks (GNNs) achieve state-of-the-art performance on graph-structured data across numerous domains. Their underlying ability to represent nodes as summaries of their vicinities has proven effective for homophilous graphs in particular, in which same-type nodes tend to connect. On heterophilous graphs, in which different-type nodes are likely connected, GNNs perform less consistently, as neighborhood information might be less representative or even misleading. On the other hand, GNN performance is not inferior on all heterophilous graphs, and there is a lack of understanding of what other graph properties affect GNN performance. In this work, we highlight the limitations of the widely used homophily ratio and the recent Cross-Class Neighborhood Similarity (CCNS) metric in estimating GNN performance. To overcome these limitations, we introduce 2-hop Neighbor Class Similarity (2NCS), a new quantitative graph structural property that correlates with GNN performance more strongly and consistently than alternative metrics. 2NCS considers two-hop neighborhoods as a theoretically derived consequence of the two-step label propagation process governing GCN's training-inference process. Experiments on one synthetic and eight real-world graph datasets confirm consistent improvements over existing metrics in estimating the accuracy of GCN- and GAT-based architectures on the node classification task.

Deep neural networks are usually trained with stochastic gradient descent (SGD), which minimizes objective function using very rough approximations of gradient, only averaging to the real gradient. Standard approaches like momentum or ADAM only consider a single direction, and do not try to model distance from extremum - neglecting valuable information from calculated sequence of gradients, often stagnating in some suboptimal plateau. Second order methods could exploit these missed opportunities, however, beside suffering from very large cost and numerical instabilities, many of them attract to suboptimal points like saddles due to negligence of signs of curvatures (as eigenvalues of Hessian). Saddle-free Newton method is a rare example of addressing this issue - changes saddle attraction into repulsion, and was shown to provide essential improvement for final value this way. However, it neglects noise while modelling second order behavior, focuses on Krylov subspace for numerical reasons, and requires costly eigendecomposion. Maintaining SFN advantages, there are proposed inexpensive ways for exploiting these opportunities. Second order behavior is linear dependence of first derivative - we can optimally estimate it from sequence of noisy gradients with least square linear regression, in online setting here: with weakening weights of old gradients. Statistically relevant subspace is suggested by PCA of recent noisy gradients - in online setting it can be made by slowly rotating considered directions toward new gradients, gradually replacing old directions with recent statistically relevant. Eigendecomposition can be also performed online: with regularly performed step of QR method to maintain diagonal Hessian. Outside the second order modeled subspace we can simultaneously perform gradient descent.

Classification bandits are multi-armed bandit problems whose task is to classify a given set of arms into either positive or negative class depending on whether the rate of the arms with the expected reward of at least h is not less than w for given thresholds h and w. We study a special classification bandit problem in which arms correspond to points x in d-dimensional real space with expected rewards f(x) which are generated according to a Gaussian process prior. We develop a framework algorithm for the problem using various arm selection policies and propose policies called FCB and FTSV. We show a smaller sample complexity upper bound for FCB than that for the existing algorithm of the level set estimation, in which whether f(x) is at least h or not must be decided for every arm's x. Arm selection policies depending on an estimated rate of arms with rewards of at least h are also proposed and shown to improve empirical sample complexity. According to our experimental results, the rate-estimation versions of FCB and FTSV, together with that of the popular active learning policy that selects the point with the maximum variance, outperform other policies for synthetic functions, and the version of FTSV is also the best performer for our real-world dataset.

Autonomous mobile agents such as unmanned aerial vehicles (UAVs) and mobile robots have shown huge potential for improving human productivity. These mobile agents require low power/energy consumption to have a long lifespan since they are usually powered by batteries. These agents also need to adapt to changing/dynamic environments, especially when deployed in far or dangerous locations, thus requiring efficient online learning capabilities. These requirements can be fulfilled by employing Spiking Neural Networks (SNNs) since SNNs offer low power/energy consumption due to sparse computations and efficient online learning due to bio-inspired learning mechanisms. However, a methodology is still required to employ appropriate SNN models on autonomous mobile agents. Towards this, we propose a Mantis methodology to systematically employ SNNs on autonomous mobile agents to enable energy-efficient processing and adaptive capabilities in dynamic environments. The key ideas of our Mantis include the optimization of SNN operations, the employment of a bio-plausible online learning mechanism, and the SNN model selection. The experimental results demonstrate that our methodology maintains high accuracy with a significantly smaller memory footprint and energy consumption (i.e., 3.32x memory reduction and 2.9x energy saving for an SNN model with 8-bit weights) compared to the baseline network with 32-bit weights. In this manner, our Mantis enables the employment of SNNs for resource- and energy-constrained mobile agents.

Graph Neural Networks (GNNs), originally proposed for node classification, have also motivated many recent works on edge prediction (a.k.a., link prediction). However, existing methods lack elaborate design regarding the distinctions between two tasks that have been frequently overlooked: (i) edges only constitute the topology in the node classification task but can be used as both the topology and the supervisions (i.e., labels) in the edge prediction task; (ii) the node classification makes prediction over each individual node, while the edge prediction is determinated by each pair of nodes. To this end, we propose a novel edge prediction paradigm named Edge-aware Message PassIng neuRal nEtworks (EMPIRE). Concretely, we first introduce an edge splitting technique to specify use of each edge where each edge is solely used as either the topology or the supervision (named as topology edge or supervision edge). We then develop a new message passing mechanism that generates the messages to source nodes (through topology edges) being aware of target nodes (through supervision edges). In order to emphasize the differences between pairs connected by supervision edges and pairs unconnected, we further weight the messages to highlight the relative ones that can reflect the differences. In addition, we design a novel negative node-pair sampling trick that efficiently samples 'hard' negative instances in the supervision instances, and can significantly improve the performance. Experimental results verify that the proposed method can significantly outperform existing state-of-the-art models regarding the edge prediction task on multiple homogeneous and heterogeneous graph datasets.

Vision Transformers have shown great promise recently for many vision tasks due to the insightful architecture design and attention mechanism. By revisiting the self-attention responses in Transformers, we empirically observe two interesting issues. First, Vision Transformers present a queryirrelevant behavior at deep layers, where the attention maps exhibit nearly consistent contexts in global scope, regardless of the query patch position (also head-irrelevant). Second, the attention maps are intrinsically sparse, few tokens dominate the attention weights; introducing the knowledge from ConvNets would largely smooth the attention and enhance the performance. Motivated by above observations, we generalize self-attention formulation to abstract a queryirrelevant global context directly and further integrate the global context into convolutions. The resulting model, a Fully Convolutional Vision Transformer (i.e., FCViT), purely consists of convolutional layers and firmly inherits the merits of both attention mechanism and convolutions, including dynamic property, weight sharing, and short- and long-range feature modeling, etc. Experimental results demonstrate the effectiveness of FCViT. With less than 14M parameters, our FCViT-S12 outperforms related work ResT-Lite by 3.7% top1 accuracy on ImageNet-1K. When scaling FCViT to larger models, we still perform better than previous state-of-the-art ConvNeXt with even fewer parameters. FCViT-based models also demonstrate promising transferability to downstream tasks, like object detection, instance segmentation, and semantic segmentation. Codes and models are made available at: https://github.com/ma-xu/FCViT.

Recent work leverages the expressive power of generative adversarial networks (GANs) to generate labeled synthetic datasets. These dataset generation methods often require new annotations of synthetic images, which forces practitioners to seek out annotators, curate a set of synthetic images, and ensure the quality of generated labels. We introduce the HandsOff framework, a technique capable of producing an unlimited number of synthetic images and corresponding labels after being trained on less than 50 pre-existing labeled images. Our framework avoids the practical drawbacks of prior work by unifying the field of GAN inversion with dataset generation. We generate datasets with rich pixel-wise labels in multiple challenging domains such as faces, cars, full-body human poses, and urban driving scenes. Our method achieves state-of-the-art performance in semantic segmentation, keypoint detection, and depth estimation compared to prior dataset generation approaches and transfer learning baselines. We additionally showcase its ability to address broad challenges in model development which stem from fixed, hand-annotated datasets, such as the long-tail problem in semantic segmentation.

Nowadays, fake news easily propagates through online social networks and becomes a grand threat to individuals and society. Assessing the authenticity of news is challenging due to its elaborately fabricated contents, making it difficult to obtain large-scale annotations for fake news data. Due to such data scarcity issues, detecting fake news tends to fail and overfit in the supervised setting. Recently, graph neural networks (GNNs) have been adopted to leverage the richer relational information among both labeled and unlabeled instances. Despite their promising results, they are inherently focused on pairwise relations between news, which can limit the expressive power for capturing fake news that spreads in a group-level. For example, detecting fake news can be more effective when we better understand relations between news pieces shared among susceptible users. To address those issues, we propose to leverage a hypergraph to represent group-wise interaction among news, while focusing on important news relations with its dual-level attention mechanism. Experiments based on two benchmark datasets show that our approach yields remarkable performance and maintains the high performance even with a small subset of labeled news data.

Hierarchical Reinforcement Learning (HRL) algorithms have been demonstrated to perform well on high-dimensional decision making and robotic control tasks. However, because they solely optimize for rewards, the agent tends to search the same space redundantly. This problem reduces the speed of learning and achieved reward. In this work, we present an Off-Policy HRL algorithm that maximizes entropy for efficient exploration. The algorithm learns a temporally abstracted low-level policy and is able to explore broadly through the addition of entropy to the high-level. The novelty of this work is the theoretical motivation of adding entropy to the RL objective in the HRL setting. We empirically show that the entropy can be added to both levels if the Kullback-Leibler (KL) divergence between consecutive updates of the low-level policy is sufficiently small. We performed an ablative study to analyze the effects of entropy on hierarchy, in which adding entropy to high-level emerged as the most desirable configuration. Furthermore, a higher temperature in the low-level leads to Q-value overestimation and increases the stochasticity of the environment that the high-level operates on, making learning more challenging. Our method, SHIRO, surpasses state-of-the-art performance on a range of simulated robotic control benchmark tasks and requires minimal tuning.

Adversarial patch is an important form of real-world adversarial attack that brings serious risks to the robustness of deep neural networks. Previous methods generate adversarial patches by either optimizing their perturbation values while fixing the pasting position or manipulating the position while fixing the patch's content. This reveals that the positions and perturbations are both important to the adversarial attack. For that, in this paper, we propose a novel method to simultaneously optimize the position and perturbation for an adversarial patch, and thus obtain a high attack success rate in the black-box setting. Technically, we regard the patch's position, the pre-designed hyper-parameters to determine the patch's perturbations as the variables, and utilize the reinforcement learning framework to simultaneously solve for the optimal solution based on the rewards obtained from the target model with a small number of queries. Extensive experiments are conducted on the Face Recognition (FR) task, and results on four representative FR models show that our method can significantly improve the attack success rate and query efficiency. Besides, experiments on the commercial FR service and physical environments confirm its practical application value. We also extend our method to the traffic sign recognition task to verify its generalization ability.

We introduce a machine-learning (ML)-based weather simulator--called "GraphCast"--which outperforms the most accurate deterministic operational medium-range weather forecasting system in the world, as well as all previous ML baselines. GraphCast is an autoregressive model, based on graph neural networks and a novel high-resolution multi-scale mesh representation, which we trained on historical weather data from the European Centre for Medium-Range Weather Forecasts (ECMWF)'s ERA5 reanalysis archive. It can make 10-day forecasts, at 6-hour time intervals, of five surface variables and six atmospheric variables, each at 37 vertical pressure levels, on a 0.25-degree latitude-longitude grid, which corresponds to roughly 25 x 25 kilometer resolution at the equator. Our results show GraphCast is more accurate than ECMWF's deterministic operational forecasting system, HRES, on 90.0% of the 2760 variable and lead time combinations we evaluated. GraphCast also outperforms the most accurate previous ML-based weather forecasting model on 99.2% of the 252 targets it reported. GraphCast can generate a 10-day forecast (35 gigabytes of data) in under 60 seconds on Cloud TPU v4 hardware. Unlike traditional forecasting methods, ML-based forecasting scales well with data: by training on bigger, higher quality, and more recent data, the skill of the forecasts can improve. Together these results represent a key step forward in complementing and improving weather modeling with ML, open new opportunities for fast, accurate forecasting, and help realize the promise of ML-based simulation in the physical sciences.  ( 2 min )

Various graph neural networks (GNNs) have been proposed to solve node classification tasks in machine learning for graph data. GNNs use the structural information of graph data by aggregating the features of neighboring nodes. However, they fail to directly characterize and leverage the structural information. In this paper, we propose multi-duplicated characterization of graph structures using information gain ratio (IGR) for GNNs (MSI-GNN), which enhances the performance of node classification by using an i-hop adjacency matrix as the structural information of the graph data. In MSI-GNN, the i-hop adjacency matrix is adaptively adjusted by two methods: (i) structural features in the matrix are selected based on the IGR, and (ii) the selected features in (i) for each node are duplicated and combined flexibly. In an experiment, we show that our MSI-GNN outperforms GCN, H2GCN, and GCNII in terms of average accuracies in benchmark graph datasets.  ( 2 min )

Prevailing methods for assessing and comparing generative AIs incentivize responses that serve a hypothetical representative individual. Evaluating models in these terms presumes homogeneous preferences across the population and engenders selection of agglomerative AIs, which fail to represent the diverse range of interests across individuals. We propose an alternative evaluation method that instead prioritizes inclusive AIs, which provably retain the requisite knowledge not only for subsequent response customization to particular segments of the population but also for utility-maximizing decisions.  ( 2 min )

Petrov-Galerkin formulations with optimal test functions allow for the stabilization of finite element simulations. In particular, given a discrete trial space, the optimal test space induces a numerical scheme delivering the best approximation in terms of a problem-dependent energy norm. This ideal approach has two shortcomings: first, we need to explicitly know the set of optimal test functions; and second, the optimal test functions may have large supports inducing expensive dense linear systems. Nevertheless, parametric families of PDEs are an example where it is worth investing some (offline) computational effort to obtain stabilized linear systems that can be solved efficiently, for a given set of parameters, in an online stage. Therefore, as a remedy for the first shortcoming, we explicitly compute (offline) a function mapping any PDE-parameter, to the matrix of coefficients of optimal test functions (in a basis expansion) associated with that PDE-parameter. Next, as a remedy for the second shortcoming, we use the low-rank approximation to hierarchically compress the (non-square) matrix of coefficients of optimal test functions. In order to accelerate this process, we train a neural network to learn a critical bottleneck of the compression algorithm (for a given set of PDE-parameters). When solving online the resulting (compressed) Petrov-Galerkin formulation, we employ a GMRES iterative solver with inexpensive matrix-vector multiplications thanks to the low-rank features of the compressed matrix. We perform experiments showing that the full online procedure as fast as the original (unstable) Galerkin approach. In other words, we get the stabilization with hierarchical matrices and neural networks practically for free. We illustrate our findings by means of 2D Eriksson-Johnson and Hemholtz model problems.  ( 2 min )

In recent years, reinforcement learning (RL) has become increasingly successful in its application to science and the process of scientific discovery in general. However, while RL algorithms learn to solve increasingly complex problems, interpreting the solutions they provide becomes ever more challenging. In this work, we gain insights into an RL agent's learned behavior through a post-hoc analysis based on sequence mining and clustering. Specifically, frequent and compact subroutines, used by the agent to solve a given task, are distilled as gadgets and then grouped by various metrics. This process of gadget discovery develops in three stages: First, we use an RL agent to generate data, then, we employ a mining algorithm to extract gadgets and finally, the obtained gadgets are grouped by a density-based clustering algorithm. We demonstrate our method by applying it to two quantum-inspired RL environments. First, we consider simulated quantum optics experiments for the design of high-dimensional multipartite entangled states where the algorithm finds gadgets that correspond to modern interferometer setups. Second, we consider a circuit-based quantum computing environment where the algorithm discovers various gadgets for quantum information processing, such as quantum teleportation. This approach for analyzing the policy of a learned agent is agent and environment agnostic and can yield interesting insights into any agent's policy.  ( 2 min )

Out-of-Distribution (OOD) detection, i.e., identifying whether an input is sampled from a novel distribution other than the training distribution, is a critical task for safely deploying machine learning systems in the open world. Recently, post hoc detection utilizing pre-trained models has shown promising performance and can be scaled to large-scale problems. This advance raises a natural question: Can we leverage the diversity of multiple pre-trained models to improve the performance of post hoc detection methods? In this work, we propose a detection enhancement method by ensembling multiple detection decisions derived from a zoo of pre-trained models. Our approach uses the p-value instead of the commonly used hard threshold and leverages a fundamental framework of multiple hypothesis testing to control the true positive rate of In-Distribution (ID) data. We focus on the usage of model zoos and provide systematic empirical comparisons with current state-of-the-art methods on various OOD detection benchmarks. The proposed ensemble scheme shows consistent improvement compared to single-model detectors and significantly outperforms the current competitive methods. Our method substantially improves the relative performance by 65.40% and 26.96% on the CIFAR10 and ImageNet benchmarks.  ( 2 min )

As machine learning being used increasingly in making high-stakes decisions, an arising challenge is to avoid unfair AI systems that lead to discriminatory decisions for protected population. A direct approach for obtaining a fair predictive model is to train the model through optimizing its prediction performance subject to fairness constraints, which achieves Pareto efficiency when trading off performance against fairness. Among various fairness metrics, the ones based on the area under the ROC curve (AUC) are emerging recently because they are threshold-agnostic and effective for unbalanced data. In this work, we formulate the training problem of a fairness-aware machine learning model as an AUC optimization problem subject to a class of AUC-based fairness constraints. This problem can be reformulated as a min-max optimization problem with min-max constraints, which we solve by stochastic first-order methods based on a new Bregman divergence designed for the special structure of the problem. We numerically demonstrate the effectiveness of our approach on real-world data under different fairness metrics.  ( 2 min )

Imperfect information games (IIG) are games in which each player only partially observes the current game state. We study how to learn $\epsilon$-optimal strategies in a zero-sum IIG through self-play with trajectory feedback. We give a problem-independent lower bound $\mathcal{O}(H(A_{\mathcal{X}}+B_{\mathcal{Y}})/\epsilon^2)$ on the required number of realizations to learn these strategies with high probability, where $H$ is the length of the game, $A_{\mathcal{X}}$ and $B_{\mathcal{Y}}$ are the total number of actions for the two players. We also propose two Follow the Regularize leader (FTRL) algorithms for this setting: Balanced-FTRL which matches this lower bound, but requires the knowledge of the information set structure beforehand to define the regularization; and Adaptive-FTRL which needs $\mathcal{O}(H^2(A_{\mathcal{X}}+B_{\mathcal{Y}})/\epsilon^2)$ plays without this requirement by progressively adapting the regularization to the observations.

This paper presents a construction of a proper and stable labelled sample compression scheme of size $O(\VCD^2)$ for any finite concept class, where $\VCD$ denotes the Vapnik-Chervonenkis Dimension. The construction is based on a well-known model of machine teaching, referred to as recursive teaching dimension. This substantially improves on the currently best known bound on the size of sample compression schemes (due to Moran and Yehudayoff), which is exponential in $\VCD$. The long-standing open question whether the smallest size of a sample compression scheme is in $O(\VCD)$ remains unresolved, but our results show that research on machine teaching is a promising avenue for the study of this open problem. As further evidence of the strong connections between machine teaching and sample compression, we prove that the model of no-clash teaching, introduced by Kirkpatrick et al., can be used to define a non-trivial lower bound on the size of stable sample compression schemes.

Currently, most deep learning methods cannot solve the problem of scarcity of industrial product defect samples and significant differences in characteristics. This paper proposes an unsupervised defect detection algorithm based on a reconstruction network, which is realized using only a large number of easily obtained defect-free sample data. The network includes two parts: image reconstruction and surface defect area detection. The reconstruction network is designed through a fully convolutional autoencoder with a lightweight structure. Only a small number of normal samples are used for training so that the reconstruction network can be A defect-free reconstructed image is generated. A function combining structural loss and $\mathit{L}1$ loss is proposed as the loss function of the reconstruction network to solve the problem of poor detection of irregular texture surface defects. Further, the residual of the reconstructed image and the image to be tested is used as the possible region of the defect, and conventional image operations can realize the location of the fault. The unsupervised defect detection algorithm of the proposed reconstruction network is used on multiple defect image sample sets. Compared with other similar algorithms, the results show that the unsupervised defect detection algorithm of the reconstructed network has strong robustness and accuracy.  ( 2 min )

Over the past decade, neural networks have been successful at making predictions from biological sequences, especially in the context of regulatory genomics. As in other fields of deep learning, tools have been devised to extract features such as sequence motifs that can explain the predictions made by a trained network. Here we intend to go beyond explainable machine learning and introduce SEISM, a selective inference procedure to test the association between these extracted features and the predicted phenotype. In particular, we discuss how training a one-layer convolutional network is formally equivalent to selecting motifs maximizing some association score. We adapt existing sampling-based selective inference procedures by quantizing this selection over an infinite set to a large but finite grid. Finally, we show that sampling under a specific choice of parameters is sufficient to characterize the composite null hypothesis typically used for selective inference-a result that goes well beyond our particular framework. We illustrate the behavior of our method in terms of calibration, power and speed and discuss its power/speed trade-off with a simpler data-split strategy. SEISM paves the way to an easier analysis of neural networks used in regulatory genomics, and to more powerful methods for genome wide association studies (GWAS).  ( 2 min )

Understanding why a model makes certain predictions is crucial when adapting it for real world decision making. LIME is a popular model-agnostic feature attribution method for the tasks of classification and regression. However, the task of learning to rank in information retrieval is more complex in comparison with either classification or regression. In this work, we extend LIME to propose Rank-LIME, a model-agnostic, local, post-hoc linear feature attribution method for the task of learning to rank that generates explanations for ranked lists. We employ novel correlation-based perturbations, differentiable ranking loss functions and introduce new metrics to evaluate ranking based additive feature attribution models. We compare Rank-LIME with a variety of competing systems, with models trained on the MS MARCO datasets and observe that Rank-LIME outperforms existing explanation algorithms in terms of Model Fidelity and Explain-NDCG. With this we propose one of the first algorithms to generate additive feature attributions for explaining ranked lists.  ( 2 min )

Because of the widespread existence of noise and data corruption, recovering the true regression parameters with a certain proportion of corrupted response variables is an essential task. Methods to overcome this problem often involve robust least-squares regression, but few methods perform well when confronted with severe adaptive adversarial attacks. In many applications, prior knowledge is often available from historical data or engineering experience, and by incorporating prior information into a robust regression method, we develop an effective robust regression method that can resist adaptive adversarial attacks. First, we propose the novel TRIP (hard Thresholding approach to Robust regression with sImple Prior) algorithm, which improves the breakdown point when facing adaptive adversarial attacks. Then, to improve the robustness and reduce the estimation error caused by the inclusion of priors, we use the idea of Bayesian reweighting to construct the more robust BRHT (robust Bayesian Reweighting regression via Hard Thresholding) algorithm. We prove the theoretical convergence of the proposed algorithms under mild conditions, and extensive experiments show that under different types of dataset attacks, our algorithms outperform other benchmark ones. Finally, we apply our methods to a data-recovery problem in a real-world application involving a space solar array, demonstrating their good applicability.  ( 2 min )

This work presents a set of neural network (NN) models specifically designed for accurate and efficient fluid dynamics forecasting. In this work, we show how neural networks training can be improved by reducing data complexity through a modal decomposition technique called higher order dynamic mode decomposition (HODMD), which identifies the main structures inside flow dynamics and reconstructs the original flow using only these main structures. This reconstruction has the same number of samples and spatial dimension as the original flow, but with a less complex dynamics and preserving its main features. We also show the low computational cost required by the proposed NN models, both in their training and inference phases. The core idea of this work is to test the limits of applicability of deep learning models to data forecasting in complex fluid dynamics problems. Generalization capabilities of the models are demonstrated by using the same neural network architectures to forecast the future dynamics of four different multi-phase flows. Data sets used to train and test these deep learning models come from Direct Numerical Simulations (DNS) of these flows.  ( 2 min )

One of the key challenges in deploying RL to real-world applications is to adapt to variations of unknown environment contexts, such as changing terrains in robotic tasks and fluctuated bandwidth in congestion control. Existing works on adaptation to unknown environment contexts either assume the contexts are the same for the whole episode or assume the context variables are Markovian. However, in many real-world applications, the environment context usually stays stable for a stochastic period and then changes in an abrupt and unpredictable manner within an episode, resulting in a segment structure, which existing works fail to address. To leverage the segment structure of piecewise stable context in real-world applications, in this paper, we propose a \textit{\textbf{Se}gmented \textbf{C}ontext \textbf{B}elief \textbf{A}ugmented \textbf{D}eep~(SeCBAD)} RL method. Our method can jointly infer the belief distribution over latent context with the posterior over segment length and perform more accurate belief context inference with observed data within the current context segment. The inferred belief context can be leveraged to augment the state, leading to a policy that can adapt to abrupt variations in context. We demonstrate empirically that SeCBAD can infer context segment length accurately and outperform existing methods on a toy grid world environment and Mujuco tasks with piecewise-stable context.  ( 2 min )

Graph Neural Networks (GNNs) have been a prevailing technique for tackling various analysis tasks on graph data. A key premise for the remarkable performance of GNNs relies on complete and trustworthy initial graph descriptions (i.e., node features and graph structure), which is often not satisfied since real-world graphs are often incomplete due to various unavoidable factors. In particular, GNNs face greater challenges when both node features and graph structure are incomplete at the same time. The existing methods either focus on feature completion or structure completion. They usually rely on the matching relationship between features and structure, or employ joint learning of node representation and feature (or structure) completion in the hope of achieving mutual benefit. However, recent studies confirm that the mutual interference between features and structure leads to the degradation of GNN performance. When both features and structure are incomplete, the mismatch between features and structure caused by the missing randomness exacerbates the interference between the two, which may trigger incorrect completions that negatively affect node representation. To this end, in this paper we propose a general GNN framework based on teacher-student distillation to improve the performance of GNNs on incomplete graphs, namely T2-GNN. To avoid the interference between features and structure, we separately design feature-level and structure-level teacher models to provide targeted guidance for student model (base GNNs, such as GCN) through distillation. Then we design two personalized methods to obtain well-trained feature and structure teachers. To ensure that the knowledge of the teacher model is comprehensively and effectively distilled to the student model, we further propose a dual distillation mode to enable the student to acquire as much expert knowledge as possible.  ( 2 min )

We propose a learning-based methodology to reconstruct private information held by a population of interacting agents in order to predict an exact outcome of the underlying multi-agent interaction process, here identified as a stationary action profile. We envision a scenario where an external observer, endowed with a learning procedure, is allowed to make queries and observe the agents' reactions through private action-reaction mappings, whose collective fixed point corresponds to a stationary profile. By adopting a smart query process to iteratively collect sensible data and update parametric estimates, we establish sufficient conditions to assess the asymptotic properties of the proposed learning-based methodology so that, if convergence happens, it can only be towards a stationary action profile. This fact yields two main consequences: i) learning locally-exact surrogates of the action-reaction mappings allows the external observer to succeed in its prediction task, and ii) working with assumptions so general that a stationary profile is not even guaranteed to exist, the established sufficient conditions hence act also as certificates for the existence of such a desirable profile. Extensive numerical simulations involving typical competitive multi-agent control and decision making problems illustrate the practical effectiveness of the proposed learning-based approach.  ( 2 min )

Methods based on ordinary differential equations (ODEs) are widely used to build generative models of time-series. In addition to high computational overhead due to explicitly computing hidden states recurrence, existing ODE-based models fall short in learning sequence data with sharp transitions - common in many real-world systems - due to numerical challenges during optimization. In this work, we propose LS4, a generative model for sequences with latent variables evolving according to a state space ODE to increase modeling capacity. Inspired by recent deep state space models (S4), we achieve speedups by leveraging a convolutional representation of LS4 which bypasses the explicit evaluation of hidden states. We show that LS4 significantly outperforms previous continuous-time generative models in terms of marginal distribution, classification, and prediction scores on real-world datasets in the Monash Forecasting Repository, and is capable of modeling highly stochastic data with sharp temporal transitions. LS4 sets state-of-the-art for continuous-time latent generative models, with significant improvement of mean squared error and tighter variational lower bounds on irregularly-sampled datasets, while also being x100 faster than other baselines on long sequences.  ( 2 min )

To improve uncertainty quantification of variance networks, we propose a novel tree-structured local neural network model that partitions the feature space into multiple regions based on uncertainty heterogeneity. A tree is built upon giving the training data, whose leaf nodes represent different regions where region-specific neural networks are trained to predict both the mean and the variance for quantifying uncertainty. The proposed Uncertainty-Splitting Neural Regression Tree (USNRT) employs novel splitting criteria. At each node, a neural network is trained on the full data first, and a statistical test for the residuals is conducted to find the best split, corresponding to the two sub-regions with the most significant uncertainty heterogeneity. USNRT is computationally friendly because very few leaf nodes are sufficient and pruning is unnecessary. On extensive UCI datasets, in terms of both calibration and sharpness, USNRT shows superior performance compared to some recent popular methods for variance prediction, including vanilla variance network, deep ensemble, dropout-based methods, tree-based models, etc. Through comprehensive visualization and analysis, we uncover how USNRT works and show its merits.  ( 2 min )

Iterative regularization is a classic idea in regularization theory, that has recently become popular in machine learning. On the one hand, it allows to design efficient algorithms controlling at the same time numerical and statistical accuracy. On the other hand it allows to shed light on the learning curves observed while training neural networks. In this paper, we focus on iterative regularization in the context of classification. After contrasting this setting with that of regression and inverse problems, we develop an iterative regularization approach based on the use of the hinge loss function. More precisely we consider a diagonal approach for a family of algorithms for which we prove convergence as well as rates of convergence. Our approach compares favorably with other alternatives, as confirmed also in numerical simulations.  ( 2 min )

In recent years, the exponential proliferation of smart devices with their intelligent applications poses severe challenges on conventional cellular networks. Such challenges can be potentially overcome by integrating communication, computing, caching, and control (i4C) technologies. In this survey, we first give a snapshot of different aspects of the i4C, comprising background, motivation, leading technological enablers, potential applications, and use cases. Next, we describe different models of communication, computing, caching, and control (4C) to lay the foundation of the integration approach. We review current state-of-the-art research efforts related to the i4C, focusing on recent trends of both conventional and artificial intelligence (AI)-based integration approaches. We also highlight the need for intelligence in resources integration. Then, we discuss integration of sensing and communication (ISAC) and classify the integration approaches into various classes. Finally, we propose open challenges and present future research directions for beyond 5G networks, such as 6G.

We study the close interplay between error and compression in the non-parametric multiclass classification setting in terms of prototype learning rules. We focus in particular on a recently proposed compression-based learning rule termed OptiNet (Kontorovich, Sabato, and Urner 2016; Kontorovich, Sabato, and Weiss 2017; Hanneke et al. 2021). Beyond its computational merits, this rule has been recently shown to be universally consistent in any metric instance space that admits a universally consistent rule--the first learning algorithm known to enjoy this property. However, its error and compression rates have been left open. Here we derive such rates in the case where instances reside in Euclidean space under commonly posed smoothness and tail conditions on the data distribution. We first show that OptiNet achieves non-trivial compression rates while enjoying near minimax-optimal error rates. We then proceed to study a novel general compression scheme for further compressing prototype rules that locally adapts to the noise level without sacrificing accuracy. Applying it to OptiNet, we show that under a geometric margin condition, further gain in the compression rate is achieved. Experimental results comparing the performance of the various methods are presented.

Gradient-enhanced Kriging (GE-Kriging) is a well-established surrogate modelling technique for approximating expensive computational models. However, it tends to get impractical for high-dimensional problems due to the large inherent correlation matrix and the associated high-dimensional hyper-parameter tuning problem. To address these issues, we propose a new method in this paper, called sliced GE-Kriging (SGE-Kriging) for reducing both the size of the correlation matrix and the number of hyper-parameters. Firstly, we perform a derivative-based global sensitivity analysis to detect the relative importance of each input variable with respect to model response. Then, we propose to split the training sample set into multiple slices, and invoke Bayes' theorem to approximate the full likelihood function via a sliced likelihood function, in which multiple small correlation matrices are utilized to describe the correlation of the sample set. Additionally, we replace the original high-dimensional hyper-parameter tuning problem with a low-dimensional counterpart by learning the relationship between the hyper-parameters and the global sensitivity indices. Finally, we validate SGE-Kriging by means of numerical experiments with several benchmarks problems. The results show that the SGE-Kriging model features an accuracy and robustness that is comparable to the standard one but comes at much less training costs. The benefits are most evident in high-dimensional problems.

Most modern probabilistic generative models, such as the variational autoencoder (VAE), have certain indeterminacies that are unresolvable even with an infinite amount of data. Different tasks tolerate different indeterminacies, however recent applications have indicated the need for strongly identifiable models, in which an observation corresponds to a unique latent code. Progress has been made towards reducing model indeterminacies while maintaining flexibility, and recent work excludes many--but not all--indeterminacies. In this work, we motivate model-identifiability in terms of task-identifiability, then construct a theoretical framework for analyzing the indeterminacies of latent variable models, which enables their precise characterization in terms of the generator function and prior distribution spaces. We reveal that strong identifiability is possible even with highly flexible nonlinear generators, and give two such examples. One is a straightforward modification of iVAE (arXiv:1907.04809 [stat.ML]); the other uses triangular monotonic maps, leading to novel connections between optimal transport and identifiability.

Modern health care systems are conducting continuous, automated surveillance of the electronic medical record (EMR) to identify adverse events with increasing frequency; however, many events such as sepsis do not have clearly elucidated prodromes (i.e., event chains) that can be used to identify and intercept the adverse event early in its course. Currently there does not exist a reliable framework for discovering or describing causal chains that precede adverse hospital events. Clinically relevant and interpretable results require a framework that can (1) infer temporal interactions across multiple patient features found in EMR data (e.g., labs, vital signs, etc.) and (2) can identify pattern(s) which precede and are specific to an impending adverse event (e.g., sepsis). In this work, we propose a linear multivariate Hawkes process model, coupled with $g(x) = x^+$ link function to allow potential inhibition effects, in order to recover a Granger Causal (GC) graph. We develop a two-phase gradient-based scheme to maximize a surrogate of likelihood to estimate the problem parameters. This two-phase algorithm is scalable and shown to be effective via our numerical simulation. It is subsequently extended to a data set of patients admitted to Grady hospital system in Atalanta, GA, where the fitted Granger Causal graph identifies several highly interpretable chains that precede sepsis.

Large pre-trained generative models are known to occasionally output undesirable samples, which undermines their trustworthiness. The common way to mitigate this is to re-train them differently from scratch using different data or different regularization -- which uses a lot of computational resources and does not always fully address the problem. In this work, we take a different, more compute-friendly approach and investigate how to post-edit a model after training so that it ''redacts'', or refrains from outputting certain kinds of samples. We show that redaction is a fundamentally different task from data deletion, and data deletion may not always lead to redaction. We then consider Generative Adversarial Networks (GANs), and provide three different algorithms for data redaction that differ on how the samples to be redacted are described. Extensive evaluations on real-world image datasets show that our algorithms out-perform data deletion baselines, and are capable of redacting data while retaining high generation quality at a fraction of the cost of full re-training.

In this paper, we develop new methods for analyzing high-dimensional tensor datasets. A tensor factor model describes a high-dimensional dataset as a sum of a low-rank component and an idiosyncratic noise, generalizing traditional factor models for panel data. We propose an estimation algorithm, called tensor principal component analysis (PCA), which generalizes the traditional PCA applicable to panel data. The algorithm involves unfolding the tensor into a sequence of matrices along different dimensions and applying PCA to the unfolded matrices. We provide theoretical results on the consistency and asymptotic distribution for tensor PCA estimator of loadings and factors. The algorithm demonstrates good performance in Mote Carlo experiments and is applied to sorted portfolios.

In many contexts, simpler models are preferable to more complex models and the control of this model complexity is the goal for many methods in machine learning such as regularization, hyperparameter tuning and architecture design. In deep learning, it has been difficult to understand the underlying mechanisms of complexity control, since many traditional measures are not naturally suitable for deep neural networks. Here we develop the notion of geometric complexity, which is a measure of the variability of the model function, computed using a discrete Dirichlet energy. Using a combination of theoretical arguments and empirical results, we show that many common training heuristics such as parameter norm regularization, spectral norm regularization, flatness regularization, implicit gradient regularization, noise regularization and the choice of parameter initialization all act to control geometric complexity, providing a unifying framework in which to characterize the behavior of deep learning models.

The study of feature propagation at initialization in neural networks lies at the root of numerous initialization designs. An assumption very commonly made in the field states that the pre-activations are Gaussian. Although this convenient Gaussian hypothesis can be justified when the number of neurons per layer tends to infinity, it is challenged by both theoretical and experimental works for finite-width neural networks. Our major contribution is to construct a family of pairs of activation functions and initialization distributions that ensure that the pre-activations remain Gaussian throughout the network's depth, even in narrow neural networks. In the process, we discover a set of constraints that a neural network should fulfill to ensure Gaussian pre-activations. Additionally, we provide a critical review of the claims of the Edge of Chaos line of works and build an exact Edge of Chaos analysis. We also propose a unified view on pre-activations propagation, encompassing the framework of several well-known initialization procedures. Finally, our work provides a principled framework for answering the much-debated question: is it desirable to initialize the training of a neural network whose pre-activations are ensured to be Gaussian?

In a variety of applications, including nonparametric instrumental variable (NPIV) analysis, proximal causal inference under unmeasured confounding, and missing-not-at-random data with shadow variables, we are interested in inference on a continuous linear functional (e.g., average causal effects) of nuisance function (e.g., NPIV regression) defined by conditional moment restrictions. These nuisance functions are generally weakly identified, in that the conditional moment restrictions can be severely ill-posed as well as admit multiple solutions. This is sometimes resolved by imposing strong conditions that imply the function can be estimated at rates that make inference on the functional possible. In this paper, we study a novel condition for the functional to be strongly identified even when the nuisance function is not; that is, the functional is amenable to asymptotically-normal estimation at $\sqrt{n}$-rates. The condition implies the existence of debiasing nuisance functions, and we propose penalized minimax estimators for both the primary and debiasing nuisance functions. The proposed nuisance estimators can accommodate flexible function classes, and importantly they can converge to fixed limits determined by the penalization regardless of the identifiability of the nuisances. We use the penalized nuisance estimators to form a debiased estimator for the functional of interest and prove its asymptotic normality under generic high-level conditions, which provide for asymptotically valid confidence intervals. We also illustrate our method in a novel partially linear proximal causal inference problem and a partially linear instrumental variable regression problem.

As machine learning algorithms are deployed on sensitive data in critical decision making processes, it is becoming increasingly important that they are also private and fair. In this paper, we show that, when the data has a long-tailed structure, it is not possible to build accurate learning algorithms that are both private and results in higher accuracy on minority subpopulations. We further show that relaxing overall accuracy can lead to good fairness even with strict privacy requirements. To corroborate our theoretical results in practice, we provide an extensive set of experimental results using a variety of synthetic, vision (CIFAR10 and CelebA), and tabular (Law School) datasets and learning algorithms.

The stochastic approximation (SA) algorithm is a widely used probabilistic method for finding a zero or a fixed point of a vector-valued funtion, when only noisy measurements of the function are available. In the literature to date, one makes a distinction between ``synchronous'' updating, whereby every component of the current guess is updated at each time, and ``asynchronous'' updating, whereby only one component is updated. In this paper, we study an intermediate situation that we call ``batch asynchronous stochastic approximation'' (BASA), in which, at each time instant, \textit{some but not all} components of the current estimated solution are updated. BASA allows the user to trade off memory requirements against time complexity. We develop a general methodology for proving that such algorithms converge to the fixed point of the map under study. These convergence proofs make use of weaker hypotheses than existing results. Specifically, existing convergence proofs require that the measurement noise is a zero-mean i.i.d\ sequence or a martingale difference sequence. In the present paper, we permit biased measurements, that is, measurement noises that have nonzero conditional mean. Also, all convergence results to date assume that the stochastic step sizes satisfy a probabilistic analog of the well-known Robbins-Monro conditions. We replace this assumption by a purely deterministic condition on the irreducibility of the underlying Markov processes. As specific applications to Reinforcement Learning, we analyze the temporal difference algorithm $TD(\lambda)$ for value iteration, and the $Q$-learning algorithm for finding the optimal action-value function. In both cases, we establish the convergence of these algorithms, under milder conditions than in the existing literature.

In this paper, we present a simple yet effective method (ABSGD) for addressing the data imbalance issue in deep learning. Our method is a simple modification to momentum SGD where we leverage an attentional mechanism to assign an individual importance weight to each gradient in the mini-batch. Unlike many existing heuristic-driven methods for tackling data imbalance, our method is grounded in {\it theoretically justified distributionally robust optimization (DRO)}, which is guaranteed to converge to a stationary point of an information-regularized DRO problem. The individual-level weight of a sampled data is systematically proportional to the exponential of a scaled loss value of the data, where the scaling factor is interpreted as the regularization parameter in the framework of information-regularized DRO. Compared with existing class-level weighting schemes, our method can capture the diversity between individual examples within each class. Compared with existing individual-level weighting methods using meta-learning that require three backward propagations for computing mini-batch stochastic gradients, our method is more efficient with only one backward propagation at each iteration as in standard deep learning methods. To balance between the learning of feature extraction layers and the learning of the classifier layer, we employ a two-stage method that uses SGD for pretraining followed by ABSGD for learning a robust classifier and finetuning lower layers. Our empirical studies on several benchmark datasets demonstrate the effectiveness of the proposed method.

We investigate how the activation function can be used to describe neural firing in an abstract way, and in turn, why it works well in artificial neural networks. We discuss how a spike in a biological neurone belongs to a particular universality class of phase transitions in statistical physics. We then show that the artificial neurone is, mathematically, a mean field model of biological neural membrane dynamics, which arises from modelling spiking as a phase transition. This allows us to treat selective neural firing in an abstract way, and formalise the role of the activation function in perceptron learning. The resultant statistical physical model allows us to recover the expressions for some known activation functions as various special cases. Along with deriving this model and specifying the analogous neural case, we analyse the phase transition to understand the physics of neural network learning. Together, it is shown that there is not only a biological meaning, but a physical justification, for the emergence and performance of typical activation functions; implications for neural learning and inference are also discussed.

Data-driven soft sensors are extensively used in industrial and chemical processes to predict hard-to-measure process variables whose real value is difficult to track during routine operations. The regression models used by these sensors often require a large number of labeled examples, yet obtaining the label information can be very expensive given the high time and cost required by quality inspections. In this context, active learning methods can be highly beneficial as they can suggest the most informative labels to query. However, most of the active learning strategies proposed for regression focus on the offline setting. In this work, we adapt some of these approaches to the stream-based scenario and show how they can be used to select the most informative data points. We also demonstrate how to use a semi-supervised architecture based on orthogonal autoencoders to learn salient features in a lower dimensional space. The Tennessee Eastman Process is used to compare the predictive performance of the proposed approaches.

Platelet products are both expensive and have very short shelf lives. As usage rates for platelets are highly variable, the effective management of platelet demand and supply is very important yet challenging. The primary goal of this paper is to present an efficient forecasting model for platelet demand at Canadian Blood Services (CBS). To accomplish this goal, four different demand forecasting methods, ARIMA (Auto Regressive Moving Average), Prophet, lasso regression (least absolute shrinkage and selection operator) and LSTM (Long Short-Term Memory) networks are utilized and evaluated. We use a large clinical dataset for a centralized blood distribution centre for four hospitals in Hamilton, Ontario, spanning from 2010 to 2018 and consisting of daily platelet transfusions along with information such as the product specifications, the recipients' characteristics, and the recipients' laboratory test results. This study is the first to utilize different methods from statistical time series models to data-driven regression and a machine learning technique for platelet transfusion using clinical predictors and with different amounts of data. We find that the multivariate approaches have the highest accuracy in general, however, if sufficient data are available, a simpler time series approach such as ARIMA appears to be sufficient. We also comment on the approach to choose clinical indicators (inputs) for the multivariate models.

Generalized Eigenvalue Problems (GEPs) encompass a range of interesting dimensionality reduction methods. Development of efficient stochastic approaches to these problems would allow them to scale to larger datasets. Canonical Correlation Analysis (CCA) is one example of a GEP for dimensionality reduction which has found extensive use in problems with two or more views of the data. Deep learning extensions of CCA require large mini-batch sizes, and therefore large memory consumption, in the stochastic setting to achieve good performance and this has limited its application in practice. Inspired by the Generalized Hebbian Algorithm, we develop an approach to solving stochastic GEPs in which all constraints are softly enforced by Lagrange multipliers. Then by considering the integral of this Lagrangian function, its pseudo-utility, and inspired by recent formulations of Principal Components Analysis and GEPs as games with differentiable utilities, we develop a game-theory inspired approach to solving GEPs. We show that our approaches share much of the theoretical grounding of the previous Hebbian and game theoretic approaches for the linear case but our method permits extension to general function approximators like neural networks for certain GEPs for dimensionality reduction including CCA which means our method can be used for deep multiview representation learning. We demonstrate the effectiveness of our method for solving GEPs in the stochastic setting using canonical multiview datasets and demonstrate state-of-the-art performance for optimizing Deep CCA.

Iterative regularization is a classic idea in regularization theory, that has recently become popular in machine learning. On the one hand, it allows to design efficient algorithms controlling at the same time numerical and statistical accuracy. On the other hand it allows to shed light on the learning curves observed while training neural networks. In this paper, we focus on iterative regularization in the context of classification. After contrasting this setting with that of regression and inverse problems, we develop an iterative regularization approach based on the use of the hinge loss function. More precisely we consider a diagonal approach for a family of algorithms for which we prove convergence as well as rates of convergence. Our approach compares favorably with other alternatives, as confirmed also in numerical simulations.

Traffic flow prediction is an important part of smart transportation. The goal is to predict future traffic conditions based on historical data recorded by sensors and the traffic network. As the city continues to build, parts of the transportation network will be added or modified. How to accurately predict expanding and evolving long-term streaming networks is of great significance. To this end, we propose a new simulation-based criterion that considers teaching autonomous agents to mimic sensor patterns, planning their next visit based on the sensor's profile (e.g., traffic, speed, occupancy). The data recorded by the sensor is most accurate when the agent can perfectly simulate the sensor's activity pattern. We propose to formulate the problem as a continuous reinforcement learning task, where the agent is the next flow value predictor, the action is the next time-series flow value in the sensor, and the environment state is a dynamically fused representation of the sensor and transportation network. Actions taken by the agent change the environment, which in turn forces the agent's mode to update, while the agent further explores changes in the dynamic traffic network, which helps the agent predict its next visit more accurately. Therefore, we develop a strategy in which sensors and traffic networks update each other and incorporate temporal context to quantify state representations evolving over time.

Knowledge distillation (KD) has been actively studied for image classification tasks in deep learning, aiming to improve the performance of a student based on the knowledge from a teacher. However, applying KD in image regression with a scalar response variable has been rarely studied, and there exists no KD method applicable to both classification and regression tasks yet. Moreover, existing KD methods often require a practitioner to carefully select or adjust the teacher and student architectures, making these methods less flexible in practice. To address the above problems in a unified way, we propose a comprehensive KD framework based on cGANs, termed cGAN-KD. Fundamentally different from existing KD methods, cGAN-KD distills and transfers knowledge from a teacher model to a student model via cGAN-generated samples. This novel mechanism makes cGAN-KD suitable for both classification and regression tasks, compatible with other KD methods, and insensitive to the teacher and student architectures. An error bound for a student model trained in the cGAN-KD framework is derived in this work, providing a theory for why cGAN-KD is effective as well as guiding the practical implementation of cGAN-KD. Extensive experiments on CIFAR-100 and ImageNet-100 show that we can combine state of the art KD methods with the cGAN-KD framework to yield a new state of the art. Moreover, experiments on Steering Angle and UTKFace demonstrate the effectiveness of cGAN-KD in image regression tasks, where existing KD methods are inapplicable.

At the core of insurance business lies classification between risky and non-risky insureds, actuarial fairness meaning that risky insureds should contribute more and pay a higher premium than non-risky or less-risky ones. Actuaries, therefore, use econometric or machine learning techniques to classify, but the distinction between a fair actuarial classification and "discrimination" is subtle. For this reason, there is a growing interest about fairness and discrimination in the actuarial community Lindholm, Richman, Tsanakas, and Wuthrich (2022). Presumably, non-sensitive characteristics can serve as substitutes or proxies for protected attributes. For example, the color and model of a car, combined with the driver's occupation, may lead to an undesirable gender bias in the prediction of car insurance prices. Surprisingly, we will show that debiasing the predictor alone may be insufficient to maintain adequate accuracy (1). Indeed, the traditional pricing model is currently built in a two-stage structure that considers many potentially biased components such as car or geographic risks. We will show that this traditional structure has significant limitations in achieving fairness. For this reason, we have developed a novel pricing model approach. Recently some approaches have Blier-Wong, Cossette, Lamontagne, and Marceau (2021); Wuthrich and Merz (2021) shown the value of autoencoders in pricing. In this paper, we will show that (2) this can be generalized to multiple pricing factors (geographic, car type), (3) it perfectly adapted for a fairness context (since it allows to debias the set of pricing components): We extend this main idea to a general framework in which a single whole pricing model is trained by generating the geographic and car pricing components needed to predict the pure premium while mitigating the unwanted bias according to the desired metric.

Causal mediation analysis can unpack the black box of causality and is therefore a powerful tool for disentangling causal pathways in biomedical and social sciences, and also for evaluating machine learning fairness. To reduce bias for estimating Natural Direct and Indirect Effects in mediation analysis, we propose a new method called DeepMed that uses deep neural networks (DNNs) to cross-fit the infinite-dimensional nuisance functions in the efficient influence functions. We obtain novel theoretical results that our DeepMed method (1) can achieve semiparametric efficiency bound without imposing sparsity constraints on the DNN architecture and (2) can adapt to certain low dimensional structures of the nuisance functions, significantly advancing the existing literature on DNN-based semiparametric causal inference. Extensive synthetic experiments are conducted to support our findings and also expose the gap between theory and practice. As a proof of concept, we apply DeepMed to analyze two real datasets on machine learning fairness and reach conclusions consistent with previous findings.

Methods based on ordinary differential equations (ODEs) are widely used to build generative models of time-series. In addition to high computational overhead due to explicitly computing hidden states recurrence, existing ODE-based models fall short in learning sequence data with sharp transitions - common in many real-world systems - due to numerical challenges during optimization. In this work, we propose LS4, a generative model for sequences with latent variables evolving according to a state space ODE to increase modeling capacity. Inspired by recent deep state space models (S4), we achieve speedups by leveraging a convolutional representation of LS4 which bypasses the explicit evaluation of hidden states. We show that LS4 significantly outperforms previous continuous-time generative models in terms of marginal distribution, classification, and prediction scores on real-world datasets in the Monash Forecasting Repository, and is capable of modeling highly stochastic data with sharp temporal transitions. LS4 sets state-of-the-art for continuous-time latent generative models, with significant improvement of mean squared error and tighter variational lower bounds on irregularly-sampled datasets, while also being x100 faster than other baselines on long sequences.

Nonconvex-nonconcave minimax optimization has been the focus of intense research over the last decade due to its broad applications in machine learning and operation research. Unfortunately, most existing algorithms cannot be guaranteed to converge and always suffer from limit cycles. Their global convergence relies on certain conditions that are difficult to check, including but not limited to the global Polyak-\L{}ojasiewicz condition, the existence of a solution satisfying the weak Minty variational inequality and $\alpha$-interaction dominant condition. In this paper, we develop the first provably convergent algorithm called doubly smoothed gradient descent ascent method, which gets rid of the limit cycle without requiring any additional conditions. We further show that the algorithm has an iteration complexity of $\mathcal{O}(\epsilon^{-4})$ for finding a game stationary point, which matches the best iteration complexity of single-loop algorithms under nonconcave-concave settings. The algorithm presented here opens up a new path for designing provable algorithms for nonconvex-nonconcave minimax optimization problems.

Graph neural networks (GNN) have become the default machine learning model for relational datasets, including protein interaction networks, biological neural networks, and scientific collaboration graphs. We use tools from statistical physics and random matrix theory to precisely characterize generalization in simple graph convolution networks on the contextual stochastic block model. The derived curves are phenomenologically rich: they explain the distinction between learning on homophilic and heterophilic graphs and they predict double descent whose existence in GNNs has been questioned by recent work. Our results are the first to accurately explain the behavior not only of a stylized graph learning model but also of complex GNNs on messy real-world datasets. To wit, we use our analytic insights about homophily and heterophily to improve performance of state-of-the-art graph neural networks on several heterophilic benchmarks by a simple addition of negative self-loop filters.

Decision makers often aim to learn a treatment assignment policy under a capacity constraint on the number of agents that they can treat. When agents can respond strategically to such policies, competition arises, complicating the estimation of the effect of the policy. In this paper, we study capacity-constrained treatment assignment in the presence of such interference. We consider a dynamic model where the decision maker allocates treatments at each time step and heterogeneous agents myopically best respond to the previous treatment assignment policy. When the number of agents is large but finite, we show that the threshold for receiving treatment under a given policy converges to the policy's mean-field equilibrium threshold. Based on this result, we develop a consistent estimator for the policy effect. In simulations and a semi-synthetic experiment with data from the National Education Longitudinal Study of 1988, we demonstrate that this estimator can be used for learning capacity-constrained policies in the presence of strategic behavior.

We propose a neural network-based model for nonlinear dynamics in continuous time that can impose inductive biases on decay rates and/or frequencies. Inductive biases are helpful for training neural networks especially when training data are small. The proposed model is based on the Koopman operator theory, where the decay rate and frequency information is used by restricting the eigenvalues of the Koopman operator that describe linear evolution in a Koopman space. We use neural networks to find an appropriate Koopman space, which are trained by minimizing multi-step forecasting and backcasting errors using irregularly sampled time-series data. Experiments on various time-series datasets demonstrate that the proposed method achieves higher forecasting performance given a single short training sequence than the existing methods.

Deep neural networks are usually trained with stochastic gradient descent (SGD), which minimizes objective function using very rough approximations of gradient, only averaging to the real gradient. Standard approaches like momentum or ADAM only consider a single direction, and do not try to model distance from extremum - neglecting valuable information from calculated sequence of gradients, often stagnating in some suboptimal plateau. Second order methods could exploit these missed opportunities, however, beside suffering from very large cost and numerical instabilities, many of them attract to suboptimal points like saddles due to negligence of signs of curvatures (as eigenvalues of Hessian). Saddle-free Newton method is a rare example of addressing this issue - changes saddle attraction into repulsion, and was shown to provide essential improvement for final value this way. However, it neglects noise while modelling second order behavior, focuses on Krylov subspace for numerical reasons, and requires costly eigendecomposion. Maintaining SFN advantages, there are proposed inexpensive ways for exploiting these opportunities. Second order behavior is linear dependence of first derivative - we can optimally estimate it from sequence of noisy gradients with least square linear regression, in online setting here: with weakening weights of old gradients. Statistically relevant subspace is suggested by PCA of recent noisy gradients - in online setting it can be made by slowly rotating considered directions toward new gradients, gradually replacing old directions with recent statistically relevant. Eigendecomposition can be also performed online: with regularly performed step of QR method to maintain diagonal Hessian. Outside the second order modeled subspace we can simultaneously perform gradient descent.

Classically, data interpolation with a parametrized model class is possible as long as the number of parameters is larger than the number of equations to be satisfied. A puzzling phenomenon in deep learning is that models are trained with many more parameters than what this classical theory would suggest. We propose a partial theoretical explanation for this phenomenon. We prove that for a broad class of data distributions and model classes, overparametrization is necessary if one wants to interpolate the data smoothly. Namely we show that smooth interpolation requires $d$ times more parameters than mere interpolation, where $d$ is the ambient data dimension. We prove this universal law of robustness for any smoothly parametrized function class with polynomial size weights, and any covariate distribution verifying isoperimetry. In the case of two-layers neural networks and Gaussian covariates, this law was conjectured in prior work by Bubeck, Li and Nagaraj. We also give an interpretation of our result as an improved generalization bound for model classes consisting of smooth functions.

Kernel machines have sustained continuous progress in the field of quantum chemistry. In particular, they have proven to be successful in the low-data regime of force field reconstruction. This is because many physical invariances and symmetries can be incorporated into the kernel function to compensate for much larger datasets. So far, the scalability of this approach has however been hindered by its cubical runtime in the number of training points. While it is known, that iterative Krylov subspace solvers can overcome these burdens, they crucially rely on effective preconditioners, which are elusive in practice. Practical preconditioners need to be computationally efficient and numerically robust at the same time. Here, we consider the broad class of Nystr\"om-type methods to construct preconditioners based on successively more sophisticated low-rank approximations of the original kernel matrix, each of which provides a different set of computational trade-offs. All considered methods estimate the relevant subspace spanned by the kernel matrix columns using different strategies to identify a representative set of inducing points. Our comprehensive study covers the full spectrum of approaches, starting from naive random sampling to leverage score estimates and incomplete Cholesky factorizations, up to exact SVD decompositions.

In various fields of data science, researchers are often interested in estimating the ratio of conditional expectation functions (CEFR). Specifically in causal inference problems, it is sometimes natural to consider ratio-based treatment effects, such as odds ratios and hazard ratios, and even difference-based treatment effects are identified as CEFR in some empirically relevant settings. This chapter develops the general framework for estimation and inference on CEFR, which allows the use of flexible machine learning for infinite-dimensional nuisance parameters. In the first stage of the framework, the orthogonal signals are constructed using debiased machine learning techniques to mitigate the negative impacts of the regularization bias in the nuisance estimates on the target estimates. The signals are then combined with a novel series estimator tailored for CEFR. We derive the pointwise and uniform asymptotic results for estimation and inference on CEFR, including the validity of the Gaussian bootstrap, and provide low-level sufficient conditions to apply the proposed framework to some specific examples. We demonstrate the finite-sample performance of the series estimator constructed under the proposed framework by numerical simulations. Finally, we apply the proposed method to estimate the causal effect of the 401(k) program on household assets.  ( 2 min )

This paper concerns the central issues of model robustness and sample efficiency in offline reinforcement learning (RL), which aims to learn to perform decision making from history data without active exploration. Due to uncertainties and variabilities of the environment, it is critical to learn a robust policy -- with as few samples as possible -- that performs well even when the deployed environment deviates from the nominal one used to collect the history dataset. We consider a distributionally robust formulation of offline RL, focusing on tabular robust Markov decision processes with an uncertainty set specified by the Kullback-Leibler divergence in both finite-horizon and infinite-horizon settings. To combat with sample scarcity, a model-based algorithm that combines distributionally robust value iteration with the principle of pessimism in the face of uncertainty is proposed, by penalizing the robust value estimates with a carefully designed data-driven penalty term. Under a mild and tailored assumption of the history dataset that measures distribution shift without requiring full coverage of the state-action space, we establish the finite-sample complexity of the proposed algorithm, and further show it is almost unimprovable in light of a nearly-matching information-theoretic lower bound up to a polynomial factor of the (effective) horizon length. To the best our knowledge, this provides the first provably near-optimal robust offline RL algorithm that learns under model uncertainty and partial coverage.

We propose an efficient method to learn both unstructured and structured sparse neural networks during training, using a novel generalization of the sparse envelope function (SEF) used as a regularizer, termed {\itshape{group sparse envelope function}} (GSEF). The GSEF acts as a neuron group selector, which we leverage to induce structured pruning. Our method receives a hardware-friendly structured sparsity of a deep neural network (DNN) to efficiently accelerate the DNN's evaluation. This method is flexible in the sense that it allows any hardware to dictate the definition of a group, such as a filter, channel, filter shape, layer depth, a single parameter (unstructured), etc. By the nature of the GSEF, the proposed method is the first to make possible a pre-define sparsity level that is being achieved at the training convergence, while maintaining negligible network accuracy degradation. We propose an efficient method to calculate the exact value of the GSEF along with its proximal operator, in a worst-case complexity of $O(n)$, where $n$ is the total number of groups variables. In addition, we propose a proximal-gradient-based optimization method to train the model, that is, the non-convex minimization of the sum of the neural network loss and the GSEF. Finally, we conduct an experiment and illustrate the efficiency of our proposed technique in terms of the completion ratio, accuracy, and inference latency.

Recent literature has advocated the use of randomized methods for accelerating the solution of various matrix problems arising throughout data science and computational science. One popular strategy for leveraging randomization is to use it as a way to reduce problem size. However, methods based on this strategy lack sufficient accuracy for some applications. Randomized preconditioning is another approach for leveraging randomization, which provides higher accuracy. The main challenge in using randomized preconditioning is the need for an underlying iterative method, thus randomized preconditioning so far have been applied almost exclusively to solving regression problems and linear systems. In this article, we show how to expand the application of randomized preconditioning to another important set of problems prevalent across data science: optimization problems with (generalized) orthogonality constraints. We demonstrate our approach, which is based on the framework of Riemannian optimization and Riemannian preconditioning, on the problem of computing the dominant canonical correlations and on the Fisher linear discriminant analysis problem. For both problems, we evaluate the effect of preconditioning on the computational costs and asymptotic convergence, and demonstrate empirically the utility of our approach.

We introduce a pivot for exact selective inference with randomization. Not only does our pivot lead to exact inference in Gaussian regression models, but it is also available in closed form. We reduce the problem of exact selective inference to a bivariate truncated Gaussian distribution. By doing so, we give up some power that is achieved with approximate inference in Panigrahi and Taylor (2022). Yet we always produce narrower confidence intervals than a closely related data-splitting procedure. For popular instances of Gaussian regression, this price -- in terms of power -- in exchange for exact selective inference is demonstrated in simulated experiments and in an HIV drug resistance analysis.

To improve uncertainty quantification of variance networks, we propose a novel tree-structured local neural network model that partitions the feature space into multiple regions based on uncertainty heterogeneity. A tree is built upon giving the training data, whose leaf nodes represent different regions where region-specific neural networks are trained to predict both the mean and the variance for quantifying uncertainty. The proposed Uncertainty-Splitting Neural Regression Tree (USNRT) employs novel splitting criteria. At each node, a neural network is trained on the full data first, and a statistical test for the residuals is conducted to find the best split, corresponding to the two sub-regions with the most significant uncertainty heterogeneity. USNRT is computationally friendly because very few leaf nodes are sufficient and pruning is unnecessary. On extensive UCI datasets, in terms of both calibration and sharpness, USNRT shows superior performance compared to some recent popular methods for variance prediction, including vanilla variance network, deep ensemble, dropout-based methods, tree-based models, etc. Through comprehensive visualization and analysis, we uncover how USNRT works and show its merits.  ( 2 min )

As machine learning being used increasingly in making high-stakes decisions, an arising challenge is to avoid unfair AI systems that lead to discriminatory decisions for protected population. A direct approach for obtaining a fair predictive model is to train the model through optimizing its prediction performance subject to fairness constraints, which achieves Pareto efficiency when trading off performance against fairness. Among various fairness metrics, the ones based on the area under the ROC curve (AUC) are emerging recently because they are threshold-agnostic and effective for unbalanced data. In this work, we formulate the training problem of a fairness-aware machine learning model as an AUC optimization problem subject to a class of AUC-based fairness constraints. This problem can be reformulated as a min-max optimization problem with min-max constraints, which we solve by stochastic first-order methods based on a new Bregman divergence designed for the special structure of the problem. We numerically demonstrate the effectiveness of our approach on real-world data under different fairness metrics.  ( 2 min )

In this work, we propose a novel framework for estimating the dimension of the data manifold using a trained diffusion model. A trained diffusion model approximates the gradient of the log density of a noise-corrupted version of the target distribution for varying levels of corruption. If the data concentrates around a manifold embedded in the high-dimensional ambient space, then as the level of corruption decreases, the score function points towards the manifold, as this direction becomes the direction of maximum likelihood increase. Therefore, for small levels of corruption, the diffusion model provides us with access to an approximation of the normal bundle of the data manifold. This allows us to estimate the dimension of the tangent space, thus, the intrinsic dimension of the data manifold. Our method outperforms linear methods for dimensionality detection such as PPCA in controlled experiments.  ( 2 min )

Imperfect information games (IIG) are games in which each player only partially observes the current game state. We study how to learn $\epsilon$-optimal strategies in a zero-sum IIG through self-play with trajectory feedback. We give a problem-independent lower bound $\mathcal{O}(H(A_{\mathcal{X}}+B_{\mathcal{Y}})/\epsilon^2)$ on the required number of realizations to learn these strategies with high probability, where $H$ is the length of the game, $A_{\mathcal{X}}$ and $B_{\mathcal{Y}}$ are the total number of actions for the two players. We also propose two Follow the Regularize leader (FTRL) algorithms for this setting: Balanced-FTRL which matches this lower bound, but requires the knowledge of the information set structure beforehand to define the regularization; and Adaptive-FTRL which needs $\mathcal{O}(H^2(A_{\mathcal{X}}+B_{\mathcal{Y}})/\epsilon^2)$ plays without this requirement by progressively adapting the regularization to the observations.  ( 2 min )

High-dimensional data arises in numerous applications, and the rapidly developing field of geometric deep learning seeks to develop neural network architectures to analyze such data in non-Euclidean domains, such as graphs and manifolds. Recent work by Z. Wang, L. Ruiz, and A. Ribeiro has introduced a method for constructing manifold neural networks using the spectral decomposition of the Laplace Beltrami operator. Moreover, in this work, the authors provide a numerical scheme for implementing such neural networks when the manifold is unknown and one only has access to finitely many sample points. The authors show that this scheme, which relies upon building a data-driven graph, converges to the continuum limit as the number of sample points tends to infinity. Here, we build upon this result by establishing a rate of convergence that depends on the intrinsic dimension of the manifold but is independent of the ambient dimension. We also discuss how the rate of convergence depends on the depth of the network and the number of filters used in each layer.  ( 2 min )

A canonical algorithm for log-concave sampling is the Langevin Algorithm, aka the Langevin Diffusion run with some discretization stepsize $\eta > 0$. This discretization leads the Langevin Algorithm to have a stationary distribution $\pi_{\eta}$ which differs from the stationary distribution $\pi$ of the Langevin Diffusion, and it is an important challenge to understand whether the well-known properties of $\pi$ extend to $\pi_{\eta}$. In particular, while concentration properties such as isoperimetry and rapidly decaying tails are classically known for $\pi$, the analogous properties for $\pi_{\eta}$ are open questions with direct algorithmic implications. This note provides a first step in this direction by establishing concentration results for $\pi_{\eta}$ that mirror classical results for $\pi$. Specifically, we show that for any nontrivial stepsize $\eta > 0$, $\pi_{\eta}$ is sub-exponential (respectively, sub-Gaussian) when the potential is convex (respectively, strongly convex). Moreover, the concentration bounds we show are essentially tight. Key to our analysis is the use of a rotation-invariant moment generating function (aka Bessel function) to study the stationary dynamics of the Langevin Algorithm. This technique may be of independent interest because it enables directly analyzing the discrete-time stationary distribution $\pi_{\eta}$ without going through the continuous-time stationary distribution $\pi$ as an intermediary.  ( 2 min )

Over the past decade, neural networks have been successful at making predictions from biological sequences, especially in the context of regulatory genomics. As in other fields of deep learning, tools have been devised to extract features such as sequence motifs that can explain the predictions made by a trained network. Here we intend to go beyond explainable machine learning and introduce SEISM, a selective inference procedure to test the association between these extracted features and the predicted phenotype. In particular, we discuss how training a one-layer convolutional network is formally equivalent to selecting motifs maximizing some association score. We adapt existing sampling-based selective inference procedures by quantizing this selection over an infinite set to a large but finite grid. Finally, we show that sampling under a specific choice of parameters is sufficient to characterize the composite null hypothesis typically used for selective inference-a result that goes well beyond our particular framework. We illustrate the behavior of our method in terms of calibration, power and speed and discuss its power/speed trade-off with a simpler data-split strategy. SEISM paves the way to an easier analysis of neural networks used in regulatory genomics, and to more powerful methods for genome wide association studies (GWAS).  ( 2 min )

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7 AI tools for 3D modeling, AR, and VR. Point-E Kaedim Kinetix Thishousedoesnotexist 5.Dpth Dream Fusion ChatARKit What would you add? submitted by /u/TheVellerShow [link] [comments]  ( 51 min )

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In a press release by the NHS, they said “Use of cutting-edge AI technology is associated with tripling of patients recovering and able to perform daily activities from 16% to 48%” Now that's a tri-ing jump, get it? How does it work? I hear you ask The technology analyses the brain CT scans of stroke patients arriving at the hospital, taking less than a minute to identify the type and severity of the stroke and the most appropriate treatment. Doctors can then quickly offer drugs or surgery, with the technology shortening the average time between patients arriving at the hospital and starting treatment by one hour - from 140 minutes to 79 minutes. This one is most definitely a GAME CHANGER, saving time, money, and Lives A massive win for the AI Community. This is from the AI With Vibes Newsletter, read the full issue here: https://aiwithvibes.beehiiv.com/p/openai-dumbing-chatgpt submitted by /u/Mk_Makanaki [link] [comments]  ( 52 min )

I write a daily newsletter covering things in AI and am trying to find things that everyday people might want to use. Something outside of "this has helped me write code for my new software!" Etc. submitted by /u/LightPoleBoy [link] [comments]  ( 54 min )

Hello! I approach this topic not as one who is passionately interested in AI as much as I do as someone who loves reading poetry. As such I really just try to evaluate it in its own terms, and hence it may be of some interest for you. I looked at three criteria: the music (how metrically correct it is), the language (the complexity and flair of the language) and finally how much it touches the reader. The article is linked below: https://www.lookingtoleeward.se/2022/12/26/can-ai-write-good-poetry-putting-chatgpt-to-the-test/ submitted by /u/Similar-Movie1663 [link] [comments]  ( 53 min )

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Simulating revolutions - ChatGPT and symbolic simulations, an article. submitted by /u/goronmask [link] [comments]  ( 54 min )

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I recently read this article and thought of using ChatGPT. I've been chatting with ChatGPT all week, bouncing ideas off of it to get it to help me flesh out my thoughts. I found out that these technologies are iterative. One is built on top of the last one, and each new iteration is more powerful and increases the potential for discovery in some exponential way. It's like a whole new level for these machines to grow and improve, and it's opening up all kinds of possibilities for what we might find out. Also, something like this has been going on for a while now like (JasperAI, CopyAI, Copysmith… the list goes on… maybe Google is even going to join the bandwagon with Google Assistant? Who knows). These technologies are also seriously disruptive, like we've never seen before. If you don't believe me, just spend a week chatting with ChatGPT or something similar and see for yourself. It’s obvious that these tools (yes tools) are going to be like a boost to our own creative skills, not to take over or anything, just to make them even better. So for those creative workers out there like copywriters, graphic designers and web designers, instead of worrying that you might get replaced, you can instead use this technology to your own advantage. You can use it for ideas for blog topics. You can also use it for design ideas and templates for your graphics and website. And that’s just the tip of the iceberg. People are worried that these technologies might take the jobs of regular humans because they can help companies get stuff done with less people. But I think it's important to think about how these technologies are affecting us and to make sure they're used in a responsible and helpful way for everyone. But AI is changing fast, so it's tough to say for sure how these technologies will play out in the future. We’ll see in 5-10 years at least how much AI will improve. submitted by /u/According_Complex_74 [link] [comments]  ( 68 min )

Is there a landscape generator? I'm searching for something like thispersondoesnotexist.com, but one that generates original landscape images. submitted by /u/OwnCranberry4948 [link] [comments]  ( 51 min )

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I teach high school and this is the first time I've encountered anything like this. Multiple students submitting writing assignments that are clearly AI generated. The administration seems to want to punish the students and move on. However, there is a clear learning opportunity here. It's not going to go away. The education piece needs to go beyond "how do we catch them" and "how do we avoid it." W teach students how to use other assistive technologies, why not AI? I know this is a vague and open question, but... What do you think we should be teaching our children around AI writing tech, or ai in general? Any specifics, resources or examples? submitted by /u/benny1872 [link] [comments]  ( 53 min )

Greetings! ​ Recently I was asked about a budget AI / ML workload, and decided to test it against some of my own lab GPUs. ​ I'll be adding more tests, and benchmarks over time, but below is a link to my website where I covered it. As well as the code I wrote to benchmark them. ​ Hopefully this helps someone out there. :-) ​ https://www.zb-c.tech/2022/12/26/pytorch-drag-race-tesla-k80-performance/ submitted by /u/zveroboy152 [link] [comments]  ( 65 min )

I was building a YOLOv5 object detection model, and was looking into researching synthetic methods like GANs to increase the size of my training set in an unsupervised manner. Ik few-shot GANs can be used to "hallucinate" images and labels for a classification task, but how can they be extended to hallucinate images and labels in YOLO format (basically lists out each bounding box and class)? Is there some way that I can train a GAN on images / YOLO labels, and get it to hallucinate more images / labels? submitted by /u/WeAreNebula [link] [comments]  ( 70 min )

I am trying to produce an AutoEncoder that has meaningful embeddings for dimensionality reduction. Additionally, I have a specific downstream task I have in mind to use the embeddings for, so I would like to know if it makes sense to write a loss function that considers both the reconstruction accuracy of the AutoEncoder, as well as prediction accuracy for the downstream task. If so, are there any relevant loss functions or articles I should refer to? Thanks! submitted by /u/austinv11 [link] [comments]  ( 66 min )

Dear fellows, I submitted my article to one of the Taylor & Francis journal in mid-2021. It received a reject and resubmit decision in early 2022. I undertook the major revisions and resubmitted my article in mid-2022. Its status went from under review to pending editor decision on September 2022. However, since then, there has been no update. I tried to contact the chief editor and editor-in-command in the period of last month. However, I have yet to hear from them. My paper has already been significantly delayed, and this uncertain situation worsens my anxiety. What do you think I should do in this case? submitted by /u/HQ2020 [link] [comments]  ( 64 min )

Hi all! As most of you here, I've played around a bit with CHATGPT, but felt it was annoying to always have to log into their GUI to ask the questions. To scratch my own itch and at the same time learn more about how to write my own command line interface, I created 'askai': https://github.com/maxvfischer/askai It is a simple CLI integration with OpenAI’s GPT3 models. I’ve primarily used it to get quick answers to technical questions, like: askai "How to mock user input when writing a Python pytest test?" askai "How do I remove a conda environment?" As I've found it quite helpful, I decided to spend some time to package it in a nicer way to share it with you. I've also uploaded it to PyPI to simplify the installation process. 'askai' enables you to: Ask questions and get the answers straight into your terminal Configure which model and model parameters you want to use Overwrite saved configurations when you ask questions Currently, it only supports OpenAI’s models, but my plan is to integrate more endpoints as soon as new capable NLP endpoints are popping up. I hope some of you find it useful :) submitted by /u/maktattengil [link] [comments]  ( 64 min )

In the wake of all the questions and worries about models that can generate content nearing (or exceeding, in some cases) the quality of that made of humans, there are a couple mechanisms that companies should provide alongside their models. Both vary in feasibility, but in general, both are pretty doable, at least for what we've seen so far. A hashing-based system to check whether a given piece of content was generated by the model. This can be accomplished by hashing all of the outputs of the model, and storing them. If it doesn't pose some sort of security risk for the generator, it could also provide the date of generation. A model for discriminating whether a given piece of content was generated by the model, similar to this model for GPT-2. This is necessary in addition to the simpler hashing mechanism, since it's possible for only a portion of the media to be generated. This would be imperfect, of course, but if nothing else, we should press companies enough that they feel obligated to give it a dedicated try. These mechanisms need real support - an API for developers, and a UI for less sophisticated users. They should have decent latency, and be hopefully be provided for free, at some level of usage - I understand the compute required could be enormous. Curious what others think here :) submitted by /u/Exnur0 [link] [comments]  ( 74 min )

Hi everyone, I am no programmer, and I have a very basic knowledge of machine learning, but I am fascinated by the possibilities offered by all the new models we have seen so far. Some people around me say they are not that impressed by what AIs can do, so I built a small test (with a little help by chatGPT to code the whole thing): can you always 100% distinguish between AI art or text and old works of art or literature? Here is the site: http://aiorart.com/ I find that AI-generated text is still generally easy to spot, but of course it is very challenging to go against great literary works. AI images can sometimes be truly deceptive. I wonder what you will all think of it... and how all that will evolve in the coming months! PS: The site is very crude (again, I am no programmer!). It works though. submitted by /u/Dicitur [link] [comments]  ( 77 min )

I don't remember where I've read about this, but it left a lasting impression on me as it feels intuitively true and impactful - in a manner, the learning on each datapoint pulls the network towards encoding that individual example, relying on stochastic emergence of shared features, which in turn relies on a dataset:model size ratio that prevents overfitting and a balanced dataset. Has there been any research into counteracting this phenomenon, such as more purposeful extraction of features, clever batching schemas, synthetic datapoints or anything else such? submitted by /u/derpderp3200 [link] [comments]  ( 69 min )

It doesn’t take much imagination to understand why DEN is the IATA abbreviation for the Denver airport, but the abbreviation MCO for the Orlando airport is more of a head scratcher. Here is a list of the busiest airports in the US along with a brief indication of the reason behind their abbreviations. Some require […] Airport abbreviation origins first appeared on John D. Cook.  ( 5 min )

I recently ran into the following comic strip online: [Update: Thanks to Bryan Cantanzaro for letting me know via the comments that the image above was created by Hannah Hillam. The version I found had had her copyright information edited out. I will replace the image above with a legitimate version shortly.] [Update 2: I’m […] Visually symmetric words first appeared on John D. Cook.  ( 6 min )

Artist Zhelong Xu, aka Uncle Light, brought to life Blood Moon — a 3D masterpiece combining imagination, craftsmanship and art styles from the Chinese Bronze Age — along with Kirin, a symbol of hope and good fortune, using NVIDIA technologies.  ( 7 min )

These explainers will give you the scoop on the latest tech developments from AI models to green computing.  ( 4 min )

The airplanes on display at the CoRL 2022 banquet. At the end of my last post which belatedly summarized RSS 2022, I mentioned I was also attending CoRL 2022 in a much farther away city: Auckland, New Zealand. That conference has now concluded and I thought it went well. I attended CoRL for a few reasons. I was presenting our recent ToolFlowNet paper, which is one of the major projects that I have worked on during my postdoc. I was part of the inclusion committee at CoRL, so I also got partial funding to attend. The conference is well aligned for my research interests. New Zealand is really nice at this time of the year. Unlike most of my prior conference reports where I write them as blog posts, here I have notes in this Google Doc. I was working on this while at CoRL, and it would take a lot of time to convert these to something that looks nice on the website, and Google Docs might be easier for me to do quick edits if needed. If robot learning is of interest to you, I hope you enjoy these conference notes. See you next year in Atlanta, Georgia, for CoRL 2023.  ( 1 min )

Hello! the procgen environments have "easy" and "hard" mode. https://arxiv.org/pdf/1912.01588.pdf ​ From the paper, this is the only paragraph about "easy" means - that it is a slightly different distribution of levels than "hard". Does anyone know what "easy" precisely means - what kind of distribution of levels is it? Thanks so much in advance! (and happy holidays!) https://preview.redd.it/zj7yczavjd8a1.png?width=653&format=png&auto=webp&s=bc97cc8f20b5c149dba1010f1f1c3c9158c7b4db submitted by /u/sunchipsster [link] [comments]  ( 62 min )

Motivated by neural network training in low-bit floating and fixed-point environments, this work studies the convergence of variants of SGD with computational error. Considering a general stochastic Lipschitz continuous loss function, a novel convergence result to a Clarke stationary point is presented assuming that only an approximation of its stochastic gradient can be computed as well as error in computing the SGD step itself. Different variants of SGD are then tested empirically in a variety of low-precision arithmetic environments, where improved test set accuracy is observed compared to SGD for two image recognition tasks.

The visual world can be parsimoniously characterized in terms of distinct entities with sparse interactions. Discovering this compositional structure in dynamic visual scenes has proven challenging for end-to-end computer vision approaches unless explicit instance-level supervision is provided. Slot-based models leveraging motion cues have recently shown great promise in learning to represent, segment, and track objects without direct supervision, but they still fail to scale to complex real-world multi-object videos. In an effort to bridge this gap, we take inspiration from human development and hypothesize that information about scene geometry in the form of depth signals can facilitate object-centric learning. We introduce SAVi++, an object-centric video model which is trained to predict depth signals from a slot-based video representation. By further leveraging best practices for model scaling, we are able to train SAVi++ to segment complex dynamic scenes recorded with moving cameras, containing both static and moving objects of diverse appearance on naturalistic backgrounds, without the need for segmentation supervision. Finally, we demonstrate that by using sparse depth signals obtained from LiDAR, SAVi++ is able to learn emergent object segmentation and tracking from videos in the real-world Waymo Open dataset.

Reformulating the history matching problem from a least-square mathematical optimization problem into a Markov Decision Process introduces a method in which reinforcement learning can be utilized to solve the problem. This method provides a mechanism where an artificial deep neural network agent can interact with the reservoir simulator and find multiple different solutions to the problem. Such formulation allows for solving the problem in parallel by launching multiple concurrent environments enabling the agent to learn simultaneously from all the environments at once, achieving significant speed up.

We study the ability of foundation models to learn representations for classification that are transferable to new, unseen classes. Recent results in the literature show that representations learned by a single classifier over many classes are competitive on few-shot learning problems with representations learned by special-purpose algorithms designed for such problems. We offer an explanation for this phenomenon based on the concept of class-features variability collapse, which refers to the training dynamics of deep classification networks where the feature embeddings of samples belonging to the same class tend to concentrate around their class means. More specifically, we examine the few-shot error of the learned feature map, which is the classification error of the nearest class-center classifier using centers learned from a small number of random samples from each class. Assuming that the classes appearing in the data are selected independently from a distribution, we show that the few-shot error generalizes from the training data to unseen test data, and we provide an upper bound on the expected few-shot error for new classes (selected from the same distribution) using the average few-shot error for the source classes. Additionally, we show that the few-shot error on the training data can be upper bounded using the degree of class-features variability collapse. This suggests that foundation models can provide feature maps that are transferable to new downstream tasks even with limited data available.

While the Turkish language is listed among low-resource languages, literature on Turkish automatic speech recognition (ASR) is relatively old. In this report, we present our findings on Turkish ASR with speech representation learning using HUBERT. We investigate pre-training HUBERT for Turkish with large-scale data curated from online resources. We pre-train our model using 6,500 hours of speech data from YouTube. The results show that the models are not ready for commercial use since they are not robust against disturbances that typically occur in real-world settings such as variations in accents, slang, background noise and interference. We analyze typical errors and the limitations of the models for use in commercial settings.

Learning physical systems on unstructured meshes by flat Graph neural networks (GNNs) faces the challenge of modeling the long-range interactions due to the scaling complexity w.r.t. the number of nodes, limiting the generalization under mesh refinement. On regular grids, the convolutional neural networks (CNNs) with a U-net structure can resolve this challenge by efficient stride, pooling, and upsampling operations. Nonetheless, these tools are much less developed for graph neural networks (GNNs), especially when GNNs are employed for learning large-scale mesh-based physics. The challenges arise from the highly irregular meshes and the lack of effective ways to construct the multi-level structure without losing connectivity. Inspired by the bipartite graph determination algorithm, we introduce Bi-Stride Multi-Scale Graph Neural Network (BSMS-GNN) by proposing \textit{bi-stride} as a simple pooling strategy for building the multi-level GNN. \textit{Bi-stride} pools nodes by striding every other BFS frontier; it 1) works robustly on any challenging mesh in the wild, 2) avoids using a mesh generator at coarser levels, 3) avoids the spatial proximity for building coarser levels, and 4) uses non-parametrized aggregating/returning instead of MLPs during pooling and unpooling. Experiments show that our framework significantly outperforms the state-of-the-art method's computational efficiency in representative physics-based simulation cases.

We propose a simultaneous learning and pruning algorithm capable of identifying and eliminating irrelevant structures in a neural network during the early stages of training. Thus, the computational cost of subsequent training iterations, besides that of inference, is considerably reduced. Our method, based on variational inference principles using Gaussian scale mixture priors on neural network weights, learns the variational posterior distribution of Bernoulli random variables multiplying the units/filters similarly to adaptive dropout. Our algorithm, ensures that the Bernoulli parameters practically converge to either 0 or 1, establishing a deterministic final network. We analytically derive a novel hyper-prior distribution over the prior parameters that is crucial for their optimal selection and leads to consistent pruning levels and prediction accuracy regardless of weight initialization or the size of the starting network. We prove the convergence properties of our algorithm establishing theoretical and practical pruning conditions. We evaluate the proposed algorithm on the MNIST and CIFAR-10 data sets and the commonly used fully connected and convolutional LeNet and VGG16 architectures. The simulations show that our method achieves pruning levels on par with state-of the-art methods for structured pruning, while maintaining better test-accuracy and more importantly in a manner robust with respect to network initialization and initial size.

The peer merit review of research proposals has been the major mechanism for deciding grant awards. However, research proposals have become increasingly interdisciplinary. It has been a longstanding challenge to assign interdisciplinary proposals to appropriate reviewers, so proposals are fairly evaluated. One of the critical steps in reviewer assignment is to generate accurate interdisciplinary topic labels for proposal-reviewer matching. Existing systems mainly collect topic labels manually generated by principal investigators. However, such human-reported labels can be non-accurate, incomplete, labor intensive, and time costly. What role can AI play in developing a fair and precise proposal reviewer assignment system? In this study, we collaborate with the National Science Foundation of China to address the task of automated interdisciplinary topic path detection. For this purpose, we develop a deep Hierarchical Interdisciplinary Research Proposal Classification Network (HIRPCN). Specifically, we first propose a hierarchical transformer to extract the textual semantic information of proposals. We then design an interdisciplinary graph and leverage GNNs for learning representations of each discipline in order to extract interdisciplinary knowledge. After extracting the semantic and interdisciplinary knowledge, we design a level-wise prediction component to fuse the two types of knowledge representations and detect interdisciplinary topic paths for each proposal. We conduct extensive experiments and expert evaluations on three real-world datasets to demonstrate the effectiveness of our proposed model.

Warfarin is a widely used anticoagulant, and has a narrow therapeutic range. Dosing of warfarin should be individualized, since slight overdosing or underdosing can have catastrophic or even fatal consequences. Despite much research on warfarin dosing, current dosing protocols do not live up to expectations, especially for patients sensitive to warfarin. We propose a deep reinforcement learning-based dosing model for warfarin. To overcome the issue of relatively small sample sizes in dosing trials, we use a Pharmacokinetic/ Pharmacodynamic (PK/PD) model of warfarin to simulate dose-responses of virtual patients. Applying the proposed algorithm on virtual test patients shows that this model outperforms a set of clinically accepted dosing protocols by a wide margin. We tested the robustness of our dosing protocol on a second PK/PD model and showed that its performance is comparable to the set of baseline protocols.

When robots interact with humans in homes, roads, or factories the human's behavior often changes in response to the robot. Non-stationary humans are challenging for robot learners: actions the robot has learned to coordinate with the original human may fail after the human adapts to the robot. In this paper we introduce an algorithmic formalism that enables robots (i.e., ego agents) to co-adapt alongside dynamic humans (i.e., other agents) using only the robot's low-level states, actions, and rewards. A core challenge is that humans not only react to the robot's behavior, but the way in which humans react inevitably changes both over time and between users. To deal with this challenge, our insight is that -- instead of building an exact model of the human -- robots can learn and reason over high-level representations of the human's policy and policy dynamics. Applying this insight we develop RILI: Robustly Influencing Latent Intent. RILI first embeds low-level robot observations into predictions of the human's latent strategy and strategy dynamics. Next, RILI harnesses these predictions to select actions that influence the adaptive human towards advantageous, high reward behaviors over repeated interactions. We demonstrate that -- given RILI's measured performance with users sampled from an underlying distribution -- we can probabilistically bound RILI's expected performance across new humans sampled from the same distribution. Our simulated experiments compare RILI to state-of-the-art representation and reinforcement learning baselines, and show that RILI better learns to coordinate with imperfect, noisy, and time-varying agents. Finally, we conduct two user studies where RILI co-adapts alongside actual humans in a game of tag and a tower-building task. See videos of our user studies here: https://youtu.be/WYGO5amDXbQ

Deep generative models parametrized up to a normalizing constant (e.g. energy-based models) are difficult to train by maximizing the likelihood of the data because the likelihood and/or gradients thereof cannot be explicitly or efficiently written down. Score matching is a training method, whereby instead of fitting the likelihood $\log p(x)$ for the training data, we instead fit the score function $\nabla_x \log p(x)$ -- obviating the need to evaluate the partition function. Though this estimator is known to be consistent, its unclear whether (and when) its statistical efficiency is comparable to that of maximum likelihood -- which is known to be (asymptotically) optimal. We initiate this line of inquiry in this paper, and show a tight connection between statistical efficiency of score matching and the isoperimetric properties of the distribution being estimated -- i.e. the Poincar\'e, log-Sobolev and isoperimetric constant -- quantities which govern the mixing time of Markov processes like Langevin dynamics. Roughly, we show that the score matching estimator is statistically comparable to the maximum likelihood when the distribution has a small isoperimetric constant. Conversely, if the distribution has a large isoperimetric constant -- even for simple families of distributions like exponential families with rich enough sufficient statistics -- score matching will be substantially less efficient than maximum likelihood. We suitably formalize these results both in the finite sample regime, and in the asymptotic regime. Finally, we identify a direct parallel in the discrete setting, where we connect the statistical properties of pseudolikelihood estimation with approximate tensorization of entropy and the Glauber dynamics.

Generating new samples from data sets can mitigate extra expensive operations, increased invasive procedures, and mitigate privacy issues. These novel samples that are statistically robust can be used as a temporary and intermediate replacement when privacy is a concern. This method can enable better data sharing practices without problems relating to identification issues or biases that are flaws for an adversarial attack.

Individual neurons in neural networks often represent a mixture of unrelated features. This phenomenon, called polysemanticity, can make interpreting neural networks more difficult and so we aim to understand its causes. We propose doing so through the lens of feature \emph{capacity}, which is the fractional dimension each feature consumes in the embedding space. We show that in a toy model the optimal capacity allocation tends to monosemantically represent the most important features, polysemantically represent less important features (in proportion to their impact on the loss), and entirely ignore the least important features. Polysemanticity is more prevalent when the inputs have higher kurtosis or sparsity and more prevalent in some architectures than others. Given an optimal allocation of capacity, we go on to study the geometry of the embedding space. We find a block-semi-orthogonal structure, with differing block sizes in different models, highlighting the impact of model architecture on the interpretability of its neurons.

The brains of all bilaterally symmetric animals on Earth are are divided into left and right hemispheres. The anatomy and functionality of the hemispheres have a large degree of overlap, but they specialize to possess different attributes. The left hemisphere is believed to specialize in specificity and routine, the right in generalities and novelty. In this study, we propose an artificial neural network that imitates that bilateral architecture using two convolutional neural networks with different training objectives and test it on an image classification task. The bilateral architecture outperforms architectures of similar representational capacity that don't exploit differential specialization. It demonstrates the efficacy of bilateralism and constitutes a new principle that could be incorporated into other computational neuroscientific models and used as an inductive bias when designing new ML systems. An analysis of the model can help us to understand the human brain.

There has been a growing interest in the use of Deep Neural Networks (DNNs) to solve Partial Differential Equations (PDEs). Despite the promise that such approaches hold, there are various aspects where they could be improved. Two such shortcomings are (i) their computational inefficiency relative to classical numerical methods, and (ii) the non-interpretability of a trained DNN model. In this work we present ASPINN, an anisotropic extension of our earlier work called SPINN--Sparse, Physics-informed, and Interpretable Neural Networks--to solve PDEs that addresses both these issues. ASPINNs generalize radial basis function networks. We demonstrate using a variety of examples involving elliptic and hyperbolic PDEs that the special architecture we propose is more efficient than generic DNNs, while at the same time being directly interpretable. Further, they improve upon the SPINN models we proposed earlier in that fewer nodes are require to capture the solution using ASPINN than using SPINN, thanks to the anisotropy of the local zones of influence of each node. The interpretability of ASPINN translates to a ready visualization of their weights and biases, thereby yielding more insight into the nature of the trained model. This in turn provides a systematic procedure to improve the architecture based on the quality of the computed solution. ASPINNs thus serve as an effective bridge between classical numerical algorithms and modern DNN based methods to solve PDEs. In the process, we also streamline the training of ASPINNs into a form that is closer to that of supervised learning algorithms.

Even though AI has advanced rapidly in recent years displaying success in solving highly complex problems, the class of Bongard Problems (BPs) yet remain largely unsolved by modern ML techniques. In this paper, we propose a new approach in an attempt to not only solve BPs but also extract meaning out of learned representations. This includes the reformulation of the classical BP into a reinforcement learning (RL) setting which will allow the model to gain access to counterfactuals to guide its decisions but also explain its decisions. Since learning meaningful representations in BPs is an essential sub-problem, we further make use of contrastive learning for the extraction of low level features from pixel data. Several experiments have been conducted for analyzing the general BP-RL setup, feature extraction methods and using the best combination for the feature space analysis and its interpretation.

Foundation models are subject to an ongoing heated debate, leaving open the question of progress towards AGI and dividing the community into two camps: the ones who see the arguably impressive results as evidence to the scaling hypothesis, and the others who are worried about the lack of interpretability and reasoning capabilities. By investigating to which extent causal representations might be captured by these large scale language models, we make a humble efforts towards resolving the ongoing philosophical conflicts.

Automatically generated static code warnings suffer from a large number of false alarms. Hence, developers only take action on a small percent of those warnings. To better predict which static code warnings should not be ignored, we suggest that analysts need to look deeper into their algorithms to find choices that better improve the particulars of their specific problem. Specifically, we show here that effective predictors of such warnings can be created by methods that locally adjust the decision boundary (between actionable warnings and others). These methods yield a new high water-mark for recognizing actionable static code warnings. For eight open-source Java projects (cassandra, jmeter, commons, lucene-solr, maven, ant, tomcat, derby) we achieve perfect test results on 4/8 datasets and, overall, a median AUC (area under the true negatives, true positives curve) of 92%.

An important problem with machine learning is that when label number n>2, it is very difficult to construct and optimize a group of learning functions, and we wish that optimized learning functions are still useful when prior distribution P(x) (where x is an instance) is changed. To resolve this problem, the semantic information G theory, Logical Bayesian Inference (LBI), and a group of Channel Matching (CM) algorithms together form a systematic solution. A semantic channel in the G theory consists of a group of truth functions or membership functions. In comparison with likelihood functions, Bayesian posteriors, and Logistic functions used by popular methods, membership functions can be more conveniently used as learning functions without the above problem. In Logical Bayesian Inference (LBI), every label's learning is independent. For Multilabel learning, we can directly obtain a group of optimized membership functions from a big enough sample with labels, without preparing different samples for different labels. A group of Channel Matching (CM) algorithms is developed for machine learning. For the Maximum Mutual Information (MMI) classification of three classes with Gaussian distributions on a two-dimensional feature space, 2-3 iterations can make mutual information between three classes and three labels surpass 99% of the MMI for most initial partitions. For mixture models, the Expectation-Maximization (EM) algorithm is improved and becomes the CM-EM algorithm, which can outperform the EM algorithm when mixture ratios are imbalanced, or local convergence exists. The CM iteration algorithm needs to combine neural networks for MMI classifications on high-dimensional feature spaces. LBI needs further studies for the unification of statistics and logic.

This report describes a set of neonatal electroencephalogram (EEG) recordings graded according to the severity of abnormalities in the background pattern. The dataset consists of 169 hours of multichannel EEG from 53 neonates recorded in a neonatal intensive care unit. All neonates received a diagnosis of hypoxic-ischaemic encephalopathy (HIE), the most common cause of brain injury in full term infants. For each neonate, multiple 1-hour epochs of good quality EEG were selected and then graded for background abnormalities. The grading system assesses EEG attributes such as amplitude and frequency, continuity, sleep--wake cycling, symmetry and synchrony, and abnormal waveforms. Background severity was then categorised into 4 grades: normal or mildly abnormal EEG, moderately abnormal EEG, severely abnormal EEG, and inactive EEG. The data can be used as a reference set of multi-channel EEG for neonates with HIE, for EEG training purposes, or for developing and evaluating automated grading algorithms.

Speech emotion recognition (SER) processes speech signals to detect and characterize expressed perceived emotions. Many SER application systems often acquire and transmit speech data collected at the client-side to remote cloud platforms for inference and decision making. However, speech data carry rich information not only about emotions conveyed in vocal expressions, but also other sensitive demographic traits such as gender, age and language background. Consequently, it is desirable for SER systems to have the ability to classify emotion constructs while preventing unintended/improper inferences of sensitive and demographic information. Federated learning (FL) is a distributed machine learning paradigm that coordinates clients to train a model collaboratively without sharing their local data. This training approach appears secure and can improve privacy for SER. However, recent works have demonstrated that FL approaches are still vulnerable to various privacy attacks like reconstruction attacks and membership inference attacks. Although most of these have focused on computer vision applications, such information leakages exist in the SER systems trained using the FL technique. To assess the information leakage of SER systems trained using FL, we propose an attribute inference attack framework that infers sensitive attribute information of the clients from shared gradients or model parameters, corresponding to the FedSGD and the FedAvg training algorithms, respectively. As a use case, we empirically evaluate our approach for predicting the client's gender information using three SER benchmark datasets: IEMOCAP, CREMA-D, and MSP-Improv. We show that the attribute inference attack is achievable for SER systems trained using FL. We further identify that most information leakage possibly comes from the first layer in the SER model.

Deep learning has been the answer to many machine learning problems during the past two decades. However, it comes with two major constraints: dependency on extensive labeled data and training costs. Transfer learning in deep learning, known as Deep Transfer Learning (DTL), attempts to reduce such dependency and costs by reusing an obtained knowledge from a source data/task in training on a target data/task. Most applied DTL techniques are network/model-based approaches. These methods reduce the dependency of deep learning models on extensive training data and drastically decrease training costs. As a result, researchers detected Covid-19 infection on chest X-Rays with high accuracy at the beginning of the pandemic with minimal data using DTL techniques. Also, the training cost reduction makes DTL viable on edge devices with limited resources. Like any new advancement, DTL methods have their own limitations, and a successful transfer depends on some adjustments for different scenarios. In this paper, we review the definition and taxonomy of deep transfer learning and well-known methods. Then we investigate the DTL approaches by reviewing recent applied DTL techniques in the past five years. Further, we review some experimental analyses of DTLs to learn the best practice for applying DTL in different scenarios. Moreover, the limitations of DTLs (catastrophic forgetting dilemma and overly biased pre-trained models) are discussed, along with possible solutions and research trends.

The main target of retrosynthesis is to recursively decompose desired molecules into available building blocks. Existing template-based retrosynthesis methods follow a template selection stereotype and suffer from limited training templates, which prevents them from discovering novel reactions. To overcome this limitation, we propose an innovative retrosynthesis prediction framework that can compose novel templates beyond training templates. As far as we know, this is the first method that uses machine learning to compose reaction templates for retrosynthesis prediction. Besides, we propose an effective reactant candidate scoring model that can capture atom-level transformations, which helps our method outperform previous methods on the USPTO-50K dataset. Experimental results show that our method can produce novel templates for 15 USPTO-50K test reactions that are not covered by training templates. We have released our source implementation.

Reconstructing spectral functions from propagator data is difficult as solving the analytic continuation problem or applying an inverse integral transformation are ill-conditioned problems. Recent work has proposed using neural networks to solve this problem and has shown promising results, either matching or improving upon the performance of other methods. We generalize this approach by not only reconstructing spectral functions, but also (possible) pairs of complex poles or an infrared (IR) cutoff. We train our network on physically motivated toy functions, examine the reconstruction accuracy and check its robustness to noise. Encouraging results are found on both toy functions and genuine lattice QCD data for the gluon propagator, suggesting that this approach may lead to significant improvements over current state-of-the-art methods.

Learning to play optimally against any mixture over a diverse set of strategies is of important practical interests in competitive games. In this paper, we propose simplex-NeuPL that satisfies two desiderata simultaneously: i) learning a population of strategically diverse basis policies, represented by a single conditional network; ii) using the same network, learn best-responses to any mixture over the simplex of basis policies. We show that the resulting conditional policies incorporate prior information about their opponents effectively, enabling near optimal returns against arbitrary mixture policies in a game with tractable best-responses. We verify that such policies behave Bayes-optimally under uncertainty and offer insights in using this flexibility at test time. Finally, we offer evidence that learning best-responses to any mixture policies is an effective auxiliary task for strategic exploration, which, by itself, can lead to more performant populations.

Data-driven individualized decision making has recently received increasing research interests. Most existing methods rely on the assumption of no unmeasured confounding, which unfortunately cannot be ensured in practice especially in observational studies. Motivated by the recent proposed proximal causal inference, we develop several proximal learning approaches to estimating optimal individualized treatment regimes (ITRs) in the presence of unmeasured confounding. In particular, we establish several identification results for different classes of ITRs, exhibiting the trade-off between the risk of making untestable assumptions and the value function improvement in decision making. Based on these results, we propose several classification-based approaches to finding a variety of restricted in-class optimal ITRs and develop their theoretical properties. The appealing numerical performance of our proposed methods is demonstrated via an extensive simulation study and one real data application.

Graph Neural Networks (GNNs) have been widely applied in the semi-supervised node classification task, where a key point lies in how to sufficiently leverage the limited but valuable label information. Most of the classical GNNs solely use the known labels for computing the classification loss at the output. In recent years, several methods have been designed to additionally utilize the labels at the input. One part of the methods augment the node features via concatenating or adding them with the one-hot encodings of labels, while other methods optimize the graph structure by assuming neighboring nodes tend to have the same label. To bring into full play the rich information of labels, in this paper, we present a label-enhanced learning framework for GNNs, which first models each label as a virtual center for intra-class nodes and then jointly learns the representations of both nodes and labels. Our approach could not only smooth the representations of nodes belonging to the same class, but also explicitly encode the label semantics into the learning process of GNNs. Moreover, a training node selection technique is provided to eliminate the potential label leakage issue and guarantee the model generalization ability. Finally, an adaptive self-training strategy is proposed to iteratively enlarge the training set with more reliable pseudo labels and distinguish the importance of each pseudo-labeled node during the model training process. Experimental results on both real-world and synthetic datasets demonstrate our approach can not only consistently outperform the state-of-the-arts, but also effectively smooth the representations of intra-class nodes.

We study iterative methods for (two-stage) robust combinatorial optimization problems with discrete uncertainty. We propose a machine-learning-based heuristic to determine starting scenarios that provide strong lower bounds. To this end, we design dimension-independent features and train a Random Forest Classifier on small-dimensional instances. Experiments show that our method improves the solution process for larger instances than contained in the training set and also provides a feature importance-score which gives insights into the role of scenario properties.

We develop a method to generate predictive regions that cover a multivariate response variable with a user-specified probability. Our work is composed of two components. First, we use a deep generative model to learn a representation of the response that has a unimodal distribution. Existing multiple-output quantile regression approaches are effective in such cases, so we apply them on the learned representation, and then transform the solution to the original space of the response. This process results in a flexible and informative region that can have an arbitrary shape, a property that existing methods lack. Second, we propose an extension of conformal prediction to the multivariate response setting that modifies any method to return sets with a pre-specified coverage level. The desired coverage is theoretically guaranteed in the finite-sample case for any distribution. Experiments conducted on both real and synthetic data show that our method constructs regions that are significantly smaller compared to existing techniques.

The need for Question Answering datasets in low resource languages is the motivation of this research, leading to the development of Kencorpus Swahili Question Answering Dataset, KenSwQuAD. This dataset is annotated from raw story texts of Swahili low resource language, which is a predominantly spoken in Eastern African and in other parts of the world. Question Answering (QA) datasets are important for machine comprehension of natural language for tasks such as internet search and dialog systems. Machine learning systems need training data such as the gold standard Question Answering set developed in this research. The research engaged annotators to formulate QA pairs from Swahili texts collected by the Kencorpus project, a Kenyan languages corpus. The project annotated 1,445 texts from the total 2,585 texts with at least 5 QA pairs each, resulting into a final dataset of 7,526 QA pairs. A quality assurance set of 12.5% of the annotated texts confirmed that the QA pairs were all correctly annotated. A proof of concept on applying the set to the QA task confirmed that the dataset can be usable for such tasks. KenSwQuAD has also contributed to resourcing of the Swahili language.

Linear partial differential equations (PDEs) are an important, widely applied class of mechanistic models, describing physical processes such as heat transfer, electromagnetism, and wave propagation. In practice, specialized numerical methods based on discretization are used to solve PDEs. They generally use an estimate of the unknown model parameters and, if available, physical measurements for initialization. Such solvers are often embedded into larger scientific models or analyses with a downstream application such that error quantification plays a key role. However, by entirely ignoring parameter and measurement uncertainty, classical PDE solvers may fail to produce consistent estimates of their inherent approximation error. In this work, we approach this problem in a principled fashion by interpreting solving linear PDEs as physics-informed Gaussian process (GP) regression. Our framework is based on a key generalization of a widely-applied theorem for conditioning GPs on a finite number of direct observations to observations made via an arbitrary bounded linear operator. Crucially, this probabilistic viewpoint allows to (1) quantify the inherent discretization error; (2) propagate uncertainty about the model parameters to the solution; and (3) condition on noisy measurements. Demonstrating the strength of this formulation, we prove that it strictly generalizes methods of weighted residuals, a central class of PDE solvers including collocation, finite volume, pseudospectral, and (generalized) Galerkin methods such as finite element and spectral methods. This class can thus be directly equipped with a structured error estimate and the capability to incorporate uncertain model parameters and observations. In summary, our results enable the seamless integration of mechanistic models as modular building blocks into probabilistic models.

The Optimal transport (OT) problem is rapidly finding its way into machine learning. Favoring its use are its metric properties. Many problems admit solutions with guarantees only for objects embedded in metric spaces, and the use of non-metrics can complicate solving them. Multi-marginal OT (MMOT) generalizes OT to simultaneously transporting multiple distributions. It captures important relations that are missed if the transport only involves two distributions. Research on MMOT, however, has been focused on its existence, uniqueness, practical algorithms, and the choice of cost functions. There is a lack of discussion on the metric properties of MMOT, which limits its theoretical and practical use. Here, we prove new generalized metric properties for a family of pairwise MMOTs. We first explain the difficulty of proving this via two negative results. Afterward, we prove the MMOTs' metric properties. Finally, we show that the generalized triangle inequality of this family of MMOTs cannot be improved. We illustrate the superiority of our MMOTs over other generalized metrics, and over non-metrics in both synthetic and real tasks.

Among many clustering algorithms, the K-means clustering algorithm is widely used because of its simple algorithm and fast convergence. However, this algorithm suffers from incomplete data, where some samples have missed some of their attributes. To solve this problem, we mainly apply MM principles to restore the symmetry of the data, so that K-means could work well. We give the pseudo-code of the algorithm and use the standard datasets for experimental verification. The source code for the experiments is publicly available in the following link: \url{https://github.com/AliBeikmohammadi/MM-Optimization/blob/main/mini-project/MM%20K-means.ipynb}.

Deep spiking neural networks (SNNs) offer the promise of low-power artificial intelligence. However, training deep SNNs from scratch or converting deep artificial neural networks to SNNs without loss of performance has been a challenge. Here we propose an exact mapping from a network with Rectified Linear Units (ReLUs) to an SNN that fires exactly one spike per neuron. For our constructive proof, we assume that an arbitrary multi-layer ReLU network with or without convolutional layers, batch normalization and max pooling layers was trained to high performance on some training set. Furthermore, we assume that we have access to a representative example of input data used during training and to the exact parameters (weights and biases) of the trained ReLU network. The mapping from deep ReLU networks to SNNs causes zero percent drop in accuracy on CIFAR10, CIFAR100 and the ImageNet-like data sets Places365 and PASS. More generally our work shows that an arbitrary deep ReLU network can be replaced by an energy-efficient single-spike neural network without any loss of performance.

Correlations between factors of variation are prevalent in real-world data. Exploiting such correlations may increase predictive performance on noisy data; however, often correlations are not robust (e.g., they may change between domains, datasets, or applications) and models that exploit them do not generalize when correlations shift. Disentanglement methods aim to learn representations which capture different factors of variation in latent subspaces. A common approach involves minimizing the mutual information between latent subspaces, such that each encodes a single underlying attribute. However, this fails when attributes are correlated. We solve this problem by enforcing independence between subspaces conditioned on the available attributes, which allows us to remove only dependencies that are not due to the correlation structure present in the training data. We achieve this via an adversarial approach to minimize the conditional mutual information (CMI) between subspaces with respect to categorical variables. We first show theoretically that CMI minimization is a good objective for robust disentanglement on linear problems. We then apply our method on real-world datasets based on MNIST and CelebA, and show that it yields models that are disentangled and robust under correlation shift, including in weakly supervised settings.

Humans have an extraordinary ability to communicate and read the properties of objects by simply watching them being carried by someone else. This level of communicative skills and interpretation, available to humans, is essential for collaborative robots if they are to interact naturally and effectively. For example, suppose a robot is handing over a fragile object. In that case, the human who receives it should be informed of its fragility in advance, through an immediate and implicit message, i.e., by the direct modulation of the robot's action. This work investigates the perception of object manipulations performed with a communicative intent by two robots with different embodiments (an iCub humanoid robot and a Baxter robot). We designed the robots' movements to communicate carefulness or not during the transportation of objects. We found that not only this feature is correctly perceived by human observers, but it can elicit as well a form of motor adaptation in subsequent human object manipulations. In addition, we get an insight into which motion features may induce to manipulate an object more or less carefully.

Feature transformation aims to extract a good representation (feature) space by mathematically transforming existing features. It is crucial to address the curse of dimensionality, enhance model generalization, overcome data sparsity, and expand the availability of classic models. Current research focuses on domain knowledge-based feature engineering or learning latent representations; nevertheless, these methods are not entirely automated and cannot produce a traceable and optimal representation space. When rebuilding a feature space for a machine learning task, can these limitations be addressed concurrently? In this extension study, we present a self-optimizing framework for feature transformation. To achieve a better performance, we improved the preliminary work by (1) obtaining an advanced state representation for enabling reinforced agents to comprehend the current feature set better; and (2) resolving Q-value overestimation in reinforced agents for learning unbiased and effective policies. Finally, to make experiments more convincing than the preliminary work, we conclude by adding the outlier detection task with five datasets, evaluating various state representation approaches, and comparing different training strategies. Extensive experiments and case studies show that our work is more effective and superior.

With more and more data being collected, data-driven modeling methods have been gaining in popularity in recent years. While physically sound, classical gray-box models are often cumbersome to identify and scale, and their accuracy might be hindered by their limited expressiveness. On the other hand, classical black-box methods, typically relying on Neural Networks (NNs) nowadays, often achieve impressive performance, even at scale, by deriving statistical patterns from data. However, they remain completely oblivious to the underlying physical laws, which may lead to potentially catastrophic failures if decisions for real-world physical systems are based on them. Physically Consistent Neural Networks (PCNNs) were recently developed to address these aforementioned issues, ensuring physical consistency while still leveraging NNs to attain state-of-the-art accuracy. In this work, we scale PCNNs to model building temperature dynamics and propose a thorough comparison with classical gray-box and black-box methods. More precisely, we design three distinct PCNN extensions, thereby exemplifying the modularity and flexibility of the architecture, and formally prove their physical consistency. In the presented case study, PCNNs are shown to achieve state-of-the-art accuracy, even outperforming classical NN-based models despite their constrained structure. Our investigations furthermore provide a clear illustration of NNs achieving seemingly good performance while remaining completely physics-agnostic, which can be misleading in practice. While this performance comes at the cost of computational complexity, PCNNs on the other hand show accuracy improvements of 17-35% compared to all other physically consistent methods, paving the way for scalable physically consistent models with state-of-the-art performance.

Applying deep learning concepts from image detection and graph theory has greatly advanced protein-ligand binding affinity prediction, a challenge with enormous ramifications for both drug discovery and protein engineering. We build upon these advances by designing a novel deep learning architecture consisting of a 3-dimensional convolutional neural network utilizing channel-wise attention and two graph convolutional networks utilizing attention-based aggregation of node features. HAC-Net (Hybrid Attention-Based Convolutional Neural Network) obtains state-of-the-art results on the PDBbind v.2016 core set, the most widely recognized benchmark in the field. We extensively assess the generalizability of our model using multiple train-test splits, each of which maximizes differences between either protein structures, protein sequences, or ligand extended-connectivity fingerprints. Furthermore, we perform 10-fold cross-validation with a similarity cutoff between SMILES strings of ligands in the training and test sets, and also evaluate the performance of HAC-Net on lower-quality data. We envision that this model can be extended to a broad range of supervised learning problems related to structure-based biomolecular property prediction. All of our software is available as open source at https://github.com/gregory-kyro/HAC-Net/.

Neural fields, also known as coordinate-based or implicit neural representations, have shown a remarkable capability of representing, generating, and manipulating various forms of signals. For video representations, however, mapping pixel-wise coordinates to RGB colors has shown relatively low compression performance and slow convergence and inference speed. Frame-wise video representation, which maps a temporal coordinate to its entire frame, has recently emerged as an alternative method to represent videos, improving compression rates and encoding speed. While promising, it has still failed to reach the performance of state-of-the-art video compression algorithms. In this work, we propose FFNeRV, a novel method for incorporating flow information into frame-wise representations to exploit the temporal redundancy across the frames in videos inspired by the standard video codecs. Furthermore, we introduce a fully convolutional architecture, enabled by one-dimensional temporal grids, improving the continuity of spatial features. Experimental results show that FFNeRV yields the best performance for video compression and frame interpolation among the methods using frame-wise representations or neural fields. To reduce the model size even further, we devise a more compact convolutional architecture using the group and pointwise convolutions. With model compression techniques, including quantization-aware training and entropy coding, FFNeRV outperforms widely-used standard video codecs (H.264 and HEVC) and performs on par with state-of-the-art video compression algorithms.

Graph neural networks (GNNs) have received remarkable success in link prediction (GNNLP) tasks. Existing efforts first predefine the subgraph for the whole dataset and then apply GNNs to encode edge representations by leveraging the neighborhood structure induced by the fixed subgraph. The prominence of GNNLP methods significantly relies on the adhoc subgraph. Since node connectivity in real-world graphs is complex, one shared subgraph is limited for all edges. Thus, the choices of subgraphs should be personalized to different edges. However, performing personalized subgraph selection is nontrivial since the potential selection space grows exponentially to the scale of edges. Besides, the inference edges are not available during training in link prediction scenarios, so the selection process needs to be inductive. To bridge the gap, we introduce a Personalized Subgraph Selector (PS2) as a plug-and-play framework to automatically, personally, and inductively identify optimal subgraphs for different edges when performing GNNLP. PS2 is instantiated as a bi-level optimization problem that can be efficiently solved differently. Coupling GNNLP models with PS2, we suggest a brand-new angle towards GNNLP training: by first identifying the optimal subgraphs for edges; and then focusing on training the inference model by using the sampled subgraphs. Comprehensive experiments endorse the effectiveness of our proposed method across various GNNLP backbones (GCN, GraphSage, NGCF, LightGCN, and SEAL) and diverse benchmarks (Planetoid, OGB, and Recommendation datasets). Our code is publicly available at \url{https://github.com/qiaoyu-tan/PS2}

Many modern research fields increasingly rely on collecting and analysing massive, often unstructured, and unwieldy datasets. Consequently, there is growing interest in machine learning and artificial intelligence applications that can harness this `data deluge'. This broad nontechnical overview provides a gentle introduction to machine learning with a specific focus on medical and biological applications. We explain the common types of machine learning algorithms and typical tasks that can be solved, illustrating the basics with concrete examples from healthcare. Lastly, we provide an outlook on open challenges, limitations, and potential impacts of machine-learning-powered medicine.

This work presents a machine learning approach to optimize the energy efficiency (EE) in a multi-cell wireless network. This optimization problem is non-convex and its global optimum is difficult to find. In the literature, either simple but suboptimal approaches or optimal methods with high complexity and poor scalability are proposed. In contrast, we propose a machine learning framework to approach the global optimum. While the neural network (NN) training takes moderate time, application with the trained model requires very low computational complexity. In particular, we introduce a novel objective function based on stochastic actions to solve the non-convex optimization problem. Besides, we design a dedicated NN architecture for the multi-cell network optimization problems that is permutation-equivariant. It classifies channels according to their roles in the EE computation. In this way, we encode our domain knowledge into the NN design and shed light into the black box of machine learning. Training and testing results show that the proposed method without supervision and with reasonable computational effort achieves an EE close to the global optimum found by the branch-and-bound algorithm. Hence, the proposed approach balances between computational complexity and performance.

One of the realistic scenarios is taking a sequence of optimal actions to do a task. Reinforcement learning is the most well-known approach to deal with this kind of task in the machine learning community. Finding a suitable alternative could always be an interesting and out-of-the-box matter. Therefore, in this project, we are looking to investigate the capability of NARS and answer the question of whether NARS has the potential to be a substitute for RL or not. Particularly, we are making a comparison between $Q$-Learning and ONA on some environments developed by an Open AI gym. The source code for the experiments is publicly available in the following link: \url{https://github.com/AliBeikmohammadi/OpenNARS-for-Applications/tree/master/misc/Python}.

Dataset scaling, also known as normalization, is an essential preprocessing step in a machine learning pipeline. It is aimed at adjusting attributes scales in a way that they all vary within the same range. This transformation is known to improve the performance of classification models, but there are several scaling techniques to choose from, and this choice is not generally done carefully. In this paper, we execute a broad experiment comparing the impact of 5 scaling techniques on the performances of 20 classification algorithms among monolithic and ensemble models, applying them to 82 publicly available datasets with varying imbalance ratios. Results show that the choice of scaling technique matters for classification performance, and the performance difference between the best and the worst scaling technique is relevant and statistically significant in most cases. They also indicate that choosing an inadequate technique can be more detrimental to classification performance than not scaling the data at all. We also show how the performance variation of an ensemble model, considering different scaling techniques, tends to be dictated by that of its base model. Finally, we discuss the relationship between a model's sensitivity to the choice of scaling technique and its performance and provide insights into its applicability on different model deployment scenarios. Full results and source code for the experiments in this paper are available in a GitHub repository.\footnote{https://github.com/amorimlb/scaling\_matters}

Over the years, sequential Monte Carlo (SMC) and, equivalently, particle filter (PF) theory has gained substantial attention from researchers. However, the performance of the resampling methodology, also known as offspring selection, has not advanced recently. We propose two deterministic offspring selection methods, which strive to minimize the Kullback-Leibler (KL) divergence and the total variation (TV) distance, respectively, between the particle distribution prior and subsequent to the offspring selection. By reducing the statistical distance between the selected offspring and the joint distribution, we obtain a heuristic search procedure that performs superior to a maximum likelihood search in precisely those contexts where the latter performs better than an SMC. For SMC and particle Markov chain Monte Carlo (pMCMC), our proposed offspring selection methods always outperform or compare favorably with the two state-of-the-art resampling schemes on two models commonly used as benchmarks from the literature.

Obtaining labelled data in a particular context could be expensive and time consuming. Although different algorithms, including unsupervised learning, semi-supervised learning, self-learning have been adopted, the performance of text classification varies with context. Given the lack of labelled dataset, we proposed a novel and simple unsupervised text classification model to classify cargo content in international shipping industry using the Standard International Trade Classification (SITC) codes. Our method stems from representing words using pretrained Glove Word Embeddings and finding the most likely label using Cosine Similarity. To compare unsupervised text classification model with supervised classification, we also applied several Transformer models to classify cargo content. Due to lack of training data, the SITC numerical codes and the corresponding textual descriptions were used as training data. A small number of manually labelled cargo content data was used to evaluate the classification performances of the unsupervised classification and the Transformer based supervised classification. The comparison reveals that unsupervised classification significantly outperforms Transformer based supervised classification even after increasing the size of the training dataset by 30%. Lacking training data is a key bottleneck that prohibits deep learning models (such as Transformers) from successful practical applications. Unsupervised classification can provide an alternative efficient and effective method to classify text when there is scarce training data.

With the ever-growing model size and the limited availability of labeled training data, transfer learning has become an increasingly popular approach in many science and engineering domains. For classification problems, this work delves into the mystery of transfer learning through an intriguing phenomenon termed neural collapse (NC), where the last-layer features and classifiers of learned deep networks satisfy: (i) the within-class variability of the features collapses to zero, and (ii) the between-class feature means are maximally and equally separated. Through the lens of NC, our findings for transfer learning are the following: (i) when pre-training models, preventing intra-class variability collapse (to a certain extent) better preserves the intrinsic structures of the input data, so that it leads to better model transferability; (ii) when fine-tuning models on downstream tasks, obtaining features with more NC on downstream data results in better test accuracy on the given task. The above results not only demystify many widely used heuristics in model pre-training (e.g., data augmentation, projection head, self-supervised learning), but also leads to more efficient and principled fine-tuning method on downstream tasks that we demonstrate through extensive experimental results.

Channel charting (CC) is an unsupervised learning method allowing to locate users relative to each other without reference. From a broader perspective, it can be viewed as a way to discover a low-dimensional latent space charting the channel manifold. In this paper, this latent modeling vision is leveraged together with a recently proposed location-based beamforming (LBB) method to show that channel charting can be used for mapping channels in space or frequency. Combining CC and LBB yields a neural network resembling an autoencoder. The proposed method is empirically assessed on a channel mapping task whose objective is to predict downlink channels from uplink channels.

Beam parameter optimization in accelerators involves multiple, sometimes competing objectives. Condensing these individual objectives into a single figure of merit unavoidably results in a bias towards particular outcomes, in absence of prior knowledge often in a non-desired way. Finding an optimal objective definition then requires operators to iterate over many possible objective weights and definitions, a process that can take many times longer than the optimization itself. A more versatile approach is multi-objective optimization, which establishes the trade-off curve or Pareto front between objectives. Here we present the first results on multi-objective Bayesian optimization of a simulated laser-plasma accelerator. We find that multi-objective optimization reaches comparable performance to its single-objective counterparts while allowing for instant evaluation of entirely new objectives. This dramatically reduces the time required to find appropriate objective definitions for new problems. Additionally, our multi-objective, multi-fidelity method reduces the time required for an optimization run by an order of magnitude. It does so by dynamically choosing simulation resolution and box size, requiring fewer slow and expensive simulations as it learns about the Pareto-optimal solutions from fast low-resolution runs. The techniques demonstrated in this paper can easily be translated into many different computational and experimental use cases beyond accelerator optimization.

Profile extrusion is a continuous production process for manufacturing plastic profiles from molten polymer. Especially interesting is the design of the die, through which the melt is pressed to attain the desired shape. However, due to an inhomogeneous velocity distribution at the die exit or residual stresses inside the extrudate, the final shape of the manufactured part often deviates from the desired one. To avoid these deviations, the shape of the die can be computationally optimized, which has already been investigated in the literature using classical optimization approaches. A new approach in the field of shape optimization is the utilization of Reinforcement Learning (RL) as a learning-based optimization algorithm. RL is based on trial-and-error interactions of an agent with an environment. For each action, the agent is rewarded and informed about the subsequent state of the environment. While not necessarily superior to classical, e.g., gradient-based or evolutionary, optimization algorithms for one single problem, RL techniques are expected to perform especially well when similar optimization tasks are repeated since the agent learns a more general strategy for generating optimal shapes instead of concentrating on just one single problem. In this work, we investigate this approach by applying it to two 2D test cases. The flow-channel geometry can be modified by the RL agent using so-called Free-Form Deformation, a method where the computational mesh is embedded into a transformation spline, which is then manipulated based on the control-point positions. In particular, we investigate the impact of utilizing different agents on the training progress and the potential of wall time saving by utilizing multiple environments during training.

This article presents a dataset of 10,917 news articles with hierarchical news categories collected between January 1st 2019, and December 31st 2019. We manually labelled the articles based on a hierarchical taxonomy with 17 first-level and 109 second-level categories. This dataset can be used to train machine learning models for automatically classifying news articles by topic. This dataset can be helpful for researchers working on news structuring, classification, and predicting future events based on released news.

Real-time bidding (RTB) has become a major paradigm of display advertising. Each ad impression generated from a user visit is auctioned in real time, where demand-side platform (DSP) automatically provides bid price usually relying on the ad impression value estimation and the optimal bid price determination. However, the current bid strategy overlooks large randomness of the user behaviors (e.g., click) and the cost uncertainty caused by the auction competition. In this work, we explicitly factor in the uncertainty of estimated ad impression values and model the risk preference of a DSP under a specific state and market environment via a sequential decision process. Specifically, we propose a novel adaptive risk-aware bidding algorithm with budget constraint via reinforcement learning, which is the first to simultaneously consider estimation uncertainty and the dynamic risk tendency of a DSP. We theoretically unveil the intrinsic relation between the uncertainty and the risk tendency based on value at risk (VaR). Consequently, we propose two instantiations to model risk tendency, including an expert knowledge-based formulation embracing three essential properties and an adaptive learning method based on self-supervised reinforcement learning. We conduct extensive experiments on public datasets and show that the proposed framework outperforms state-of-the-art methods in practical settings.

Self-Supervised Learning (SSL) is crucial for real-world applications, especially in data-hungry domains such as healthcare and self-driving cars. In addition to a lack of labeled data, these applications also suffer from distributional shifts. Therefore, an SSL method should provide robust generalization and uncertainty estimation in the test dataset to be considered a reliable model in such high-stakes domains. However, existing approaches often focus on generalization, without evaluating the model's uncertainty. The ability to compare SSL techniques for improving these estimates is therefore critical for research on the reliability of self-supervision models. In this paper, we explore variants of SSL methods, including Jigsaw Puzzles, Context, Rotation, Geometric Transformations Prediction for vision, as well as BERT and GPT for language tasks. We train SSL in auxiliary learning for vision and pre-training for language model, then evaluate the generalization (in-out classification accuracy) and uncertainty (expected calibration error) across different distribution covariate shift datasets, including MNIST-C, CIFAR-10-C, CIFAR-10.1, and MNLI. Our goal is to create a benchmark with outputs from experiments, providing a starting point for new SSL methods in Reliable Machine Learning. All source code to reproduce results is available at https://github.com/hamanhbui/reliable_ssl_baselines.

Existing training criteria in automatic speech recognition(ASR) permit the model to freely explore more than one time alignments between the feature and label sequences. In this paper, we use entropy to measure a model's uncertainty, i.e. how it chooses to distribute the probability mass over the set of allowed alignments. Furthermore, we evaluate the effect of entropy regularization in encouraging the model to distribute the probability mass only on a smaller subset of allowed alignments. Experiments show that entropy regularization enables a much simpler decoding method without sacrificing word error rate, and provides better time alignment quality.

The majority of existing post-hoc explanation approaches for machine learning models produce independent per-variable feature attribution scores, ignoring a critical characteristic, such as the inter-variable relationship between features that naturally occurs in visual and textual data. In response, we develop a novel model-agnostic and permutation-based feature attribution algorithm based on the relational analysis between input variables. As a result, we are able to gain a broader insight into machine learning model decisions and data. This type of local explanation measures the effects of interrelationships between local features, which provides another critical aspect of explanations. Experimental evaluations of our framework using setups involving both image and text data modalities demonstrate its effectiveness and validity.

We study the problem of combining neural networks with symbolic reasoning. Recently introduced frameworks for Probabilistic Neurosymbolic Learning (PNL), such as DeepProbLog, perform exponential-time exact inference, limiting the scalability of PNL solutions. We introduce Approximate Neurosymbolic Inference (A-NeSI): a new framework for PNL that uses neural networks for scalable approximate inference. A-NeSI 1) performs approximate inference in polynomial time without changing the semantics of probabilistic logics; 2) is trained using data generated by the background knowledge; 3) can generate symbolic explanations of predictions; and 4) can guarantee the satisfaction of logical constraints at test time, which is vital in safety-critical applications. Our experiments show that A-NeSI is the first end-to-end method to scale the Multi-digit MNISTAdd benchmark to sums of 15 MNIST digits, up from 4 in competing systems. Finally, our experiments show that A-NeSI achieves explainability and safety without a penalty in performance.

We develop the theory and algorithmic toolbox for networked federated learning in decentralized collections of local datasets with an intrinsic network structure. This network structure arises from domain-specific notions of similarity between local datasets. Different notions of similarity are induced by spatio-temporal proximity, statistical dependencies or functional relations. Our main conceptual contribution is to formulate networked federated learning using a generalized total variation minimization. This formulation unifies and considerably extends existing federated multi-task learning methods. It is highly flexible and can be combined with a broad range of parametric models including Lasso or deep neural networks. Our main algorithmic contribution is a novel networked federated learning algorithm which is well-suited for distributed computing environments such as edge computing over wireless networks. This algorithm is robust against inexact computations due to limited computational resources. For local models resulting in convex problems, we derive precise conditions on the local models and their network structure such that our algorithm learns nearly optimal local models. Our analysis reveals an interesting interplay between the convex geometry of local models and the (cluster-) geometry of their network structure.

Real estate appraisal is a crucial issue for urban applications, which aims to value the properties on the market. Traditional methods perform appraisal based on the domain knowledge, but suffer from the efforts of hand-crafted design. Recently, several methods have been developed to automatize the valuation process by taking the property trading transaction into account when estimating the property value. However, existing methods only consider the real estate itself, ignoring the relation between the properties. Moreover, naively aggregating the information of neighbors fails to model the relationships between the transactions. To tackle these limitations, we propose a novel Neighbor Relation Graph Learning Framework (ReGram) by incorporating the relation between target transaction and surrounding neighbors with the attention mechanism. To model the influence between communities, we integrate the environmental information and the past price of each transaction from other communities. Moreover, since the target transactions in different regions share some similarities and differences of characteristics, we introduce a dynamic adapter to model the different distributions of the target transactions based on the input-related kernel weights. Extensive experiments on the real-world dataset with various scenarios demonstrate that ReGram robustly outperforms the state-of-the-art methods. Furthermore, comprehensive ablation studies were conducted to examine the effectiveness of each component in ReGram.

A major challenge when using k-means clustering often is how to choose the parameter k, the number of clusters. In this letter, we want to point out that it is very easy to draw poor conclusions from a common heuristic, the "elbow method". Better alternatives have been known in literature for a long time, and we want to draw attention to some of these easy to use options, that often perform better. This letter is a call to stop using the elbow method altogether, because it severely lacks theoretic support, and we want to encourage educators to discuss the problems of the method -- if introducing it in class at all -- and teach alternatives instead, while researchers and reviewers should reject conclusions drawn from the elbow method.

Image Super-Resolution (SR) is essential for a wide range of computer vision and image processing tasks. Investigating infrared (IR) image (or thermal images) super-resolution is a continuing concern within the development of deep learning. This survey aims to provide a comprehensive perspective of IR image super-resolution, including its applications, hardware imaging system dilemmas, and taxonomy of image processing methodologies. In addition, the datasets and evaluation metrics in IR image super-resolution tasks are also discussed. Furthermore, the deficiencies in current technologies and possible promising directions for the community to explore are highlighted. To cope with the rapid development in this field, we intend to regularly update the relevant excellent work at \url{https://github.com/yongsongH/Infrared_Image_SR_Survey  ( 2 min )

We study the problem of semantic segmentation calibration. For image classification, lots of existing solutions are proposed to alleviate model miscalibration of confidence. However, to date, confidence calibration research on semantic segmentation is still limited. We provide a systematic study on the calibration of semantic segmentation models and propose a simple yet effective approach. First, we find that model capacity, crop size, multi-scale testing, and prediction correctness have impact on calibration. Among them, prediction correctness, especially misprediction, is more important to miscalibration due to over-confidence. Next, we propose a simple, unifying, and effective approach, namely selective scaling, by separating correct/incorrect prediction for scaling and more focusing on misprediction logit smoothing. Then, we study popular existing calibration methods and compare them with selective scaling on semantic segmentation calibration. We conduct extensive experiments with a variety of benchmarks on both in-domain and domain-shift calibration, and show that selective scaling consistently outperforms other methods.  ( 2 min )

In the recent years, various gradient descent algorithms including the methods of gradient descent, gradient descent with momentum, adaptive gradient (AdaGrad), root-mean-square propagation (RMSProp) and adaptive moment estimation (Adam) have been applied to the parameter optimization of several deep learning models with higher accuracies or lower errors. These optimization algorithms may need to set the values of several hyperparameters which include a learning rate, momentum coefficients, etc. Furthermore, the convergence speed and solution accuracy may be influenced by the values of hyperparameters. Therefore, this study proposes an analytical framework to use mathematical models for analyzing the mean error of each objective function based on various gradient descent algorithms. Moreover, the suitable value of each hyperparameter could be determined by minimizing the mean error. The principles of hyperparameter value setting have been generalized based on analysis results for model optimization. The experimental results show that higher efficiency convergences and lower errors can be obtained by the proposed method.  ( 2 min )

Neural Architecture Search (NAS) is an automatic technique that can search for well-performed architectures for a specific task. Although NAS surpasses human-designed architecture in many fields, the high computational cost of architecture evaluation it requires hinders its development. A feasible solution is to directly evaluate some metrics in the initial stage of the architecture without any training. NAS without training (WOT) score is such a metric, which estimates the final trained accuracy of the architecture through the ability to distinguish different inputs in the activation layer. However, WOT score is not an atomic metric, meaning that it does not represent a fundamental indicator of the architecture. The contributions of this paper are in three folds. First, we decouple WOT into two atomic metrics which represent the distinguishing ability of the network and the number of activation units, and explore better combination rules named (Distinguishing Activation Score) DAS. We prove the correctness of decoupling theoretically and confirmed the effectiveness of the rules experimentally. Second, in order to improve the prediction accuracy of DAS to meet practical search requirements, we propose a fast training strategy. When DAS is used in combination with the fast training strategy, it yields more improvements. Third, we propose a dataset called Darts-training-bench (DTB), which fills the gap that no training states of architecture in existing datasets. Our proposed method has 1.04$\times$ - 1.56$\times$ improvements on NAS-Bench-101, Network Design Spaces, and the proposed DTB.  ( 2 min )

Networks have become indispensable and ubiquitous structures in many fields to model the interactions among different entities, such as friendship in social networks or protein interactions in biological graphs. A major challenge is to understand the structure and dynamics of these systems. Although networks evolve through time, most existing graph representation learning methods target only static networks. Whereas approaches have been developed for the modeling of dynamic networks, there is a lack of efficient continuous time dynamic graph representation learning methods that can provide accurate network characterization and visualization in low dimensions while explicitly accounting for prominent network characteristics such as homophily and transitivity. In this paper, we propose the Piecewise-Velocity Model (PiVeM) for the representation of continuous-time dynamic networks. It learns dynamic embeddings in which the temporal evolution of nodes is approximated by piecewise linear interpolations based on a latent distance model with piecewise constant node-specific velocities. The model allows for analytically tractable expressions of the associated Poisson process likelihood with scalable inference invariant to the number of events. We further impose a scalable Kronecker structured Gaussian Process prior to the dynamics accounting for community structure, temporal smoothness, and disentangled (uncorrelated) latent embedding dimensions optimally learned to characterize the network dynamics. We show that PiVeM can successfully represent network structure and dynamics in ultra-low two-dimensional spaces. It outperforms relevant state-of-art methods in downstream tasks such as link prediction. In summary, PiVeM enables easily interpretable dynamic network visualizations and characterizations that can further improve our understanding of the intrinsic dynamics of time-evolving networks.  ( 2 min )

In this paper, we present a modular methodology that combines state-of-the-art methods in (stochastic) machine learning with traditional methods in rule learning to provide efficient and scalable algorithms for the classification of vast data sets, while remaining explainable. Apart from evaluating our approach on the common large scale data sets MNIST, Fashion-MNIST and IMDB, we present novel results on explainable classifications of dental bills. The latter case study stems from an industrial collaboration with Allianz Private Krankenversicherungs-Aktiengesellschaft which is an insurance company offering diverse services in Germany.  ( 2 min )

A major goal of multimodal research is to improve machine understanding of images and text. Tasks include image captioning, text-to-image generation, and vision-language representation learning. So far, research has focused on the relationships between images and text. For example, captioning models attempt to understand the semantics of images which are then transformed into text. An important question is: which annotation reflects best a deep understanding of image content? Similarly, given a text, what is the best image that can present the semantics of the text? In this work, we argue that the best text or caption for a given image is the text which would generate the image which is the most similar to that image. Likewise, the best image for a given text is the image that results in the caption which is best aligned with the original text. To this end, we propose a unified framework that includes both a text-to-image generative model and an image-to-text generative model. Extensive experiments validate our approach.  ( 2 min )

In the era of Internet of Things (IoT), network-wide anomaly detection is a crucial part of monitoring IoT networks due to the inherent security vulnerabilities of most IoT devices. Principal Components Analysis (PCA) has been proposed to separate network traffics into two disjoint subspaces corresponding to normal and malicious behaviors for anomaly detection. However, the privacy concerns and limitations of devices' computing resources compromise the practical effectiveness of PCA. We propose a federated PCA-based Grassmannian optimization framework that coordinates IoT devices to aggregate a joint profile of normal network behaviors for anomaly detection. First, we introduce a privacy-preserving federated PCA framework to simultaneously capture the profile of various IoT devices' traffic. Then, we investigate the alternating direction method of multipliers gradient-based learning on the Grassmann manifold to guarantee fast training and the absence of detecting latency using limited computational resources. Empirical results on the NSL-KDD dataset demonstrate that our method outperforms baseline approaches. Finally, we show that the Grassmann manifold algorithm is highly adapted for IoT anomaly detection, which permits drastically reducing the analysis time of the system. To the best of our knowledge, this is the first federated PCA algorithm for anomaly detection meeting the requirements of IoT networks.  ( 2 min )

Federated learning is a collaborative model training method by iterating model updates at multiple clients and aggregation of the updates at a central server. Device and statistical heterogeneity of the participating clients cause performance degradation so that an appropriate weight should be assigned per client in the server's aggregation phase. This paper employs deep unfolding to learn the weights that adapt to the heterogeneity, which gives the model with high accuracy on uniform test data. The results of numerical experiments indicate the high performance of the proposed method and the interpretable behavior of the learned weights.  ( 2 min )

Motivated by the human-machine interaction such as training chatbots for improving customer satisfaction, we study human-guided human-machine interaction involving private information. We model this interaction as a two-player turn-based game, where one player (Alice, a human) guides the other player (Bob, a machine) towards a common goal. Specifically, we focus on offline reinforcement learning (RL) in this game, where the goal is to find a policy pair for Alice and Bob that maximizes their expected total rewards based on an offline dataset collected a priori. The offline setting presents two challenges: (i) We cannot collect Bob's private information, leading to a confounding bias when using standard RL methods, and (ii) a distributional mismatch between the behavior policy used to collect data and the desired policy we aim to learn. To tackle the confounding bias, we treat Bob's previous action as an instrumental variable for Alice's current decision making so as to adjust for the unmeasured confounding. We develop a novel identification result and use it to propose a new off-policy evaluation (OPE) method for evaluating policy pairs in this two-player turn-based game. To tackle the distributional mismatch, we leverage the idea of pessimism and use our OPE method to develop an off-policy learning algorithm for finding a desirable policy pair for both Alice and Bob. Finally, we prove that under mild assumptions such as partial coverage of the offline data, the policy pair obtained through our method converges to the optimal one at a satisfactory rate.  ( 2 min )

Multi-class ensemble classification remains a popular focus of investigation within the research community. The popularization of cloud services has sped up their adoption due to the ease of deploying large-scale machine-learning models. It has also drawn the attention of the industrial sector because of its ability to identify common problems in production. However, there are challenges to conform an ensemble classifier, namely a proper selection and effective training of the pool of classifiers, the definition of a proper architecture for multi-class classification, and uncertainty quantification of the ensemble classifier. The robustness and effectiveness of the ensemble classifier lie in the selection of the pool of classifiers, as well as in the learning process. Hence, the selection and the training procedure of the pool of classifiers play a crucial role. An (ensemble) classifier learns to detect the classes that were used during the supervised training. However, when injecting data with unknown conditions, the trained classifier will intend to predict the classes learned during the training. To this end, the uncertainty of the individual and ensemble classifier could be used to assess the learning capability. We present a novel approach for novel detection using ensemble classification and evidence theory. A pool selection strategy is presented to build a solid ensemble classifier. We present an architecture for multi-class ensemble classification and an approach to quantify the uncertainty of the individual classifiers and the ensemble classifier. We use uncertainty for the anomaly detection approach. Finally, we use the benchmark Tennessee Eastman to perform experiments to test the ensemble classifier's prediction and anomaly detection capabilities.  ( 2 min )

Tongue cancer is a common oral cavity malignancy that originates in the mouth and throat. Much effort has been invested in improving its diagnosis, treatment, and management. Surgical removal, chemotherapy, and radiation therapy remain the major treatment for tongue cancer. The survival of patients determines the treatment effect. Previous studies have identified certain survival and risk factors based on descriptive statistics, ignoring the complex, nonlinear relationship among clinical and demographic variables. In this study, we utilize five cutting-edge machine learning models and clinical data to predict the survival of tongue cancer patients after treatment. Five-fold cross-validation, bootstrap analysis, and permutation feature importance are applied to estimate and interpret model performance. The prognostic factors identified by our method are consistent with previous clinical studies. Our method is accurate, interpretable, and thus useable as additional evidence in tongue cancer treatment and management.  ( 2 min )

Data deprivation, or the lack of easily available and actionable information on the well-being of individuals, is a significant challenge for the developing world and an impediment to the design and operationalization of policies intended to alleviate poverty. In this paper we explore the suitability of data derived from OpenStreetMap to proxy for the location of two crucial public services: schools and health clinics. Thanks to the efforts of thousands of digital humanitarians, online mapping repositories such as OpenStreetMap contain millions of records on buildings and other structures, delineating both their location and often their use. Unfortunately much of this data is locked in complex, unstructured text rendering it seemingly unsuitable for classifying schools or clinics. We apply a scalable, unsupervised learning method to unlabeled OpenStreetMap building data to extract the location of schools and health clinics in ten countries in Africa. We find the topic modeling approach greatly improves performance versus reliance on structured keys alone. We validate our results by comparing schools and clinics identified by our OSM method versus those identified by the WHO, and describe OSM coverage gaps more broadly.  ( 2 min )

Regularising the parameter matrices of neural networks is ubiquitous in training deep models. Typical regularisation approaches suggest initialising weights using small random values, and to penalise weights to promote sparsity. However, these widely used techniques may be less effective in certain scenarios. Here, we study the Koopman autoencoder model which includes an encoder, a Koopman operator layer, and a decoder. These models have been designed and dedicated to tackle physics-related problems with interpretable dynamics and an ability to incorporate physics-related constraints. However, the majority of existing work employs standard regularisation practices. In our work, we take a step toward augmenting Koopman autoencoders with initialisation and penalty schemes tailored for physics-related settings. Specifically, we propose the "eigeninit" initialisation scheme that samples initial Koopman operators from specific eigenvalue distributions. In addition, we suggest the "eigenloss" penalty scheme that penalises the eigenvalues of the Koopman operator during training. We demonstrate the utility of these schemes on two synthetic data sets: a driven pendulum and flow past a cylinder; and two real-world problems: ocean surface temperatures and cyclone wind fields. We find on these datasets that eigenloss and eigeninit improves the convergence rate by up to a factor of 5, and that they reduce the cumulative long-term prediction error by up to a factor of 3. Such a finding points to the utility of incorporating similar schemes as an inductive bias in other physics-related deep learning approaches.  ( 2 min )

Network models are an essential block of modern networks. For example, they are widely used in network planning and optimization. However, as networks increase in scale and complexity, some models present limitations, such as the assumption of markovian traffic in queuing theory models, or the high computational cost of network simulators. Recent advances in machine learning, such as Graph Neural Networks (GNN), are enabling a new generation of network models that are data-driven and can learn complex non-linear behaviors. In this paper, we present RouteNet-Fermi, a custom GNN model that shares the same goals as queuing theory, while being considerably more accurate in the presence of realistic traffic models. The proposed model predicts accurately the delay, jitter, and loss in networks. We have tested RouteNet-Fermi in networks of increasing size (up to 300 nodes), including samples with mixed traffic profiles -- e.g., with complex non-markovian models -- and arbitrary routing and queue scheduling configurations. Our experimental results show that RouteNet-Fermi achieves similar accuracy as computationally-expensive packet-level simulators and it is able to accurately scale to large networks. For example, the model produces delay estimates with a mean relative error of 6.24% when applied to a test dataset with 1,000 samples, including network topologies one order of magnitude larger than those seen during training.  ( 2 min )

As the number of distributed services (or microservices) of cloud-native applications grows, resource management becomes a challenging task. These applications tend to be user-facing and latency-sensitive, and our goal is to continuously minimize the amount of CPU resources allocated while still satisfying the application latency SLO. Although previous efforts have proposed simple heuristics and sophisticated ML-based techniques, we believe that a practical resource manager should accurately scale CPU resources for diverse applications, with minimum human efforts and operation overheads. To this end, we ask: can we systematically break resource management down to subproblems solvable by practical policies? Based on the notion of CPU-throttle-based performance target, we decouple the mechanisms of SLO feedback and resource control, and implement a two-level framework -- Autothrottle. It combines a lightweight learned controller at the global level, and agile per-microservice controllers at the local level. We evaluate Autothrottle on three microservice applications, with both short-term and 21-day production workload traces. Empirical results show Autothrottle's superior CPU core savings up to 26.21% over the best-performing baselines across applications, while maintaining the latency SLO.  ( 2 min )

The availability of frequent and cost-free satellite images is in growing demand in the research world. Such satellite constellations as Landsat 8 and Sentinel-2 provide a massive amount of valuable data daily. However, the discrepancy in the sensors' characteristics of these satellites makes it senseless to use a segmentation model trained on either dataset and applied to another, which is why domain adaptation techniques have recently become an active research area in remote sensing. In this paper, an experiment of domain adaptation through style-transferring is conducted using the HRSemI2I model to narrow the sensor discrepancy between Landsat 8 and Sentinel-2. This paper's main contribution is analyzing the expediency of that approach by comparing the results of segmentation using domain-adapted images with those without adaptation. The HRSemI2I model, adjusted to work with 6-band imagery, shows significant intersection-over-union performance improvement for both mean and per class metrics. A second contribution is providing different schemes of generalization between two label schemes - NALCMS 2015 and CORINE. The first scheme is standardization through higher-level land cover classes, and the second is through harmonization validation in the field.  ( 2 min )

Learning on Graphs (LoG) is widely used in multi-client systems when each client has insufficient local data, and multiple clients have to share their raw data to learn a model of good quality. One scenario is to recommend items to clients with limited historical data and sharing similar preferences with other clients in a social network. On the other hand, due to the increasing demands for the protection of clients' data privacy, Federated Learning (FL) has been widely adopted: FL requires models to be trained in a multi-client system and restricts sharing of raw data among clients. The underlying potential data-sharing conflict between LoG and FL is under-explored and how to benefit from both sides is a promising problem. In this work, we first formulate the Graph Federated Learning (GFL) problem that unifies LoG and FL in multi-client systems and then propose sharing hidden representation instead of the raw data of neighbors to protect data privacy as a solution. To overcome the biased gradient problem in GFL, we provide a gradient estimation method and its convergence analysis under the non-convex objective. In experiments, we evaluate our method in classification tasks on graphs. Our experiment shows a good match between our theory and the practice.  ( 2 min )

Handwritten character recognition is a hot topic for research nowadays. If we can convert a handwritten piece of paper into a text-searchable document using the Optical Character Recognition (OCR) technique, we can easily understand the content and do not need to read the handwritten document. OCR in the English language is very common, but in the Bengali language, it is very hard to find a good quality OCR application. If we can merge machine learning and deep learning with OCR, it could be a huge contribution to this field. Various researchers have proposed a number of strategies for recognizing Bengali handwritten characters. A lot of ML algorithms and deep neural networks were used in their work, but the explanations of their models are not available. In our work, we have used various machine learning algorithms and CNN to recognize handwritten Bengali digits. We have got acceptable accuracy from some ML models, and CNN has given us great testing accuracy. Grad-CAM was used as an XAI method on our CNN model, which gave us insights into the model and helped us detect the origin of interest for recognizing a digit from an image.  ( 2 min )

For small training set sizes $P$, the generalization error of wide neural networks is well-approximated by the error of an infinite width neural network (NN), either in the kernel or mean-field/feature-learning regime. However, after a critical sample size $P^*$, we empirically find the finite-width network generalization becomes worse than that of the infinite width network. In this work, we empirically study the transition from infinite-width behavior to this variance limited regime as a function of sample size $P$ and network width $N$. We find that finite-size effects can become relevant for very small dataset sizes on the order of $P^* \sim \sqrt{N}$ for polynomial regression with ReLU networks. We discuss the source of these effects using an argument based on the variance of the NN's final neural tangent kernel (NTK). This transition can be pushed to larger $P$ by enhancing feature learning or by ensemble averaging the networks. We find that the learning curve for regression with the final NTK is an accurate approximation of the NN learning curve. Using this, we provide a toy model which also exhibits $P^* \sim \sqrt{N}$ scaling and has $P$-dependent benefits from feature learning.  ( 2 min )

Using a comprehensive sample of 2,585 bankruptcies from 1990 to 2019, we benchmark the performance of various machine learning models in predicting financial distress of publicly traded U.S. firms. We find that gradient boosted trees outperform other models in one-year-ahead forecasts. Variable permutation tests show that excess stock returns, idiosyncratic risk, and relative size are the more important variables for predictions. Textual features derived from corporate filings do not improve performance materially. In a credit competition model that accounts for the asymmetric cost of default misclassification, the survival random forest is able to capture large dollar profits.  ( 2 min )

Prognostication for lung cancer, a leading cause of mortality, remains a complex task, as it needs to quantify the associations of risk factors and health events spanning a patient's entire life. One challenge is that an individual's disease course involves non-terminal (e.g., disease progression) and terminal (e.g., death) events, which form semi-competing relationships. Our motivation comes from the Boston Lung Cancer Study, a large lung cancer survival cohort, which investigates how risk factors influence a patient's disease trajectory. Following developments in the prediction of time-to-event outcomes with neural networks, deep learning has become a focal area for the development of risk prediction methods in survival analysis. However, limited work has been done to predict multi-state or semi-competing risk outcomes, where a patient may experience adverse events such as disease progression prior to death. We propose a novel neural expectation-maximization algorithm to bridge the gap between classical statistical approaches and machine learning. Our algorithm enables estimation of the non-parametric baseline hazards of each state transition, risk functions of predictors, and the degree of dependence among different transitions, via a multi-task deep neural network with transition-specific sub-architectures. We apply our method to the Boston Lung Cancer Study and investigate the impact of clinical and genetic predictors on disease progression and mortality.  ( 2 min )

Stochastic Gradient Descent Langevin Dynamics (SGLD) algorithms, which add noise to the classic gradient descent, are known to improve the training of neural networks in some cases where the neural network is very deep. In this paper we study the possibilities of training acceleration for the numerical resolution of stochastic control problems through gradient descent, where the control is parametrized by a neural network. If the control is applied at many discretization times then solving the stochastic control problem reduces to minimizing the loss of a very deep neural network. We numerically show that Langevin algorithms improve the training on various stochastic control problems like hedging and resource management, and for different choices of gradient descent methods.  ( 2 min )

Practical applications of mechanical metamaterials often involve solving inverse problems where the objective is to find the (multiple) microarchitectures that give rise to a given set of properties. The limited resolution of additive manufacturing techniques often requires solving such inverse problems for specific sizes. One should, therefore, find multiple microarchitectural designs that exhibit the desired properties for a specimen with given dimensions. Moreover, the candidate microarchitectures should be resistant to fatigue and fracture, meaning that peak stresses should be minimized as well. Such a multi-objective inverse design problem is formidably difficult to solve but its solution is the key to real-world applications of mechanical metamaterials. Here, we propose a modular approach titled 'Deep-DRAM' that combines four decoupled models, including two deep learning models (DLM), a deep generative model (DGM) based on conditional variational autoencoders (CVAE), and direct finite element (FE) simulations. Deep-DRAM (deep learning for the design of random-network metamaterials) integrates these models into a unified framework capable of finding many solutions to the multi-objective inverse design problem posed here. The integrated framework first introduces the desired elastic properties to the DGM, which returns a set of candidate designs. The candidate designs, together with the target specimen dimensions are then passed to the DLM which predicts their actual elastic properties considering the specimen size. After a filtering step based on the closeness of the actual properties to the desired ones, the last step uses direct FE simulations to identify the designs with the minimum peak stresses.  ( 2 min )

Question: Can an encoder-decoder architecture pretrained on a large dataset of longitudinal electronic health records improves patient outcome predictions? Findings: In this prognostic study of 6.8 million patients, our denoising sequence-to-sequence prediction model of multiple outcomes outperformed state-of-the-art models scuh pretrained BERT on a broad range of patient outcomes, including intentional self-harm and pancreatic cancer. Meaning: Deep bidirectional and autoregressive representation improves patient outcome prediction.  ( 2 min )

Learning fair graph representations for downstream applications is becoming increasingly important, but existing work has mostly focused on improving fairness at the global level by either modifying the graph structure or objective function without taking into account the local neighborhood of a node. In this work, we formally introduce the notion of neighborhood fairness and develop a computational framework for learning such locally fair embeddings. We argue that the notion of neighborhood fairness is more appropriate since GNN-based models operate at the local neighborhood level of a node. Our neighborhood fairness framework has two main components that are flexible for learning fair graph representations from arbitrary data: the first aims to construct fair neighborhoods for any arbitrary node in a graph and the second enables adaption of these fair neighborhoods to better capture certain application or data-dependent constraints, such as allowing neighborhoods to be more biased towards certain attributes or neighbors in the graph.Furthermore, while link prediction has been extensively studied, we are the first to investigate the graph representation learning task of fair link classification. We demonstrate the effectiveness of the proposed neighborhood fairness framework for a variety of graph machine learning tasks including fair link prediction, link classification, and learning fair graph embeddings. Notably, our approach achieves not only better fairness but also increases the accuracy in the majority of cases across a wide variety of graphs, problem settings, and metrics.  ( 2 min )

Large-scale vision-language models such as CLIP have shown impressive performance on zero-shot image classification and image-to-text retrieval. However, such zero-shot performance of CLIP-based models does not realize in tasks that require a finer-grained correspondence between vision and language, such as Visual Question Answering (VQA). We investigate why this is the case, and report an interesting phenomenon of CLIP, which we call the Concept Association Bias (CAB), as a potential cause of the difficulty of applying CLIP to VQA and similar tasks. CAB is especially apparent when two concepts are present in the given image while a text prompt only contains a single concept. In such a case, we find that CLIP tends to treat input as a bag of concepts and attempts to fill in the other missing concept crossmodally, leading to an unexpected zero-shot prediction. For example, when asked for the color of a lemon in an image, CLIP predicts ``purple'' if the image contains a lemon and an eggplant. We demonstrate the Concept Association Bias of CLIP by showing that CLIP's zero-shot classification performance greatly suffers when there is a strong concept association between an object (e.g. lemon) and an attribute (e.g. its color). On the other hand, when the association between object and attribute is weak, we do not see this phenomenon. Furthermore, we show that CAB is significantly mitigated when we enable CLIP to learn deeper structure across image and text embeddings by adding an additional Transformer on top of CLIP and fine-tuning it on VQA. We find that across such fine-tuned variants of CLIP, the strength of CAB in a model predicts how well it performs on VQA.  ( 2 min )

The Elo algorithm, due to its simplicity, is widely used for rating in sports competitions as well as in other applications where the rating/ranking is a useful tool for predicting future results. However, despite its widespread use, a detailed understanding of the convergence properties of the Elo algorithm is still lacking. Aiming to fill this gap, this paper presents a comprehensive (stochastic) analysis of the Elo algorithm, considering round-robin (one-on-one) competitions. Specifically, analytical expressions are derived characterizing the behavior/evolution of the skills and of important performance metrics. Then, taking into account the relationship between the behavior of the algorithm and the step-size value, which is a hyperparameter that can be controlled, some design guidelines as well as discussions about the performance of the algorithm are provided. To illustrate the applicability of the theoretical findings, experimental results are shown, corroborating the very good match between analytical predictions and those obtained from the algorithm using real-world data (from the Italian SuperLega, Volleyball League).  ( 2 min )

The arise of cutting-edge technologies and services such as XR promise to change the concepts of how day-to-day things are done. At the same time, the appearance of modern and decentralized architectures approaches has given birth to a new generation of mobile networks such as 5G, as well as outlining the roadmap for B5G and posterior. These networks are expected to be the enablers for bringing to life the Metaverse and other futuristic approaches. In this sense, this work presents an ML-based (Machine Learning) framework that allows the estimation of service Key Quality Indicators (KQIs). For this, only information reachable to operators is required, such as statistics and configuration parameters from these networks. This strategy prevents operators from avoiding intrusion into the user data and guaranteeing privacy. To test this proposal, 360-Video has been selected as a use case of Virtual Reality (VR), from which specific KQIs are estimated such as video resolution, frame rate, initial startup time, throughput, and latency, among others. To select the best model for each KQI, a search grid with a cross-validation strategy has been used to determine the best hyperparameter tuning. To boost the creation of each KQI model, feature engineering techniques together with cross-validation strategies have been used. The performance is assessed using MAE (Mean Average Error) and the prediction time. The outcomes point out that KNR (K-Near Neighbors) and RF (Random Forest) are the best algorithms in combination with Feature Selection techniques. Likewise, this work will help as a baseline for E2E-Quality-of-Experience-based network management working in conjunction with network slicing, virtualization, and MEC, among other enabler technologies.  ( 2 min )

We propose a Target Conditioned Representation Independence (TCRI) objective for domain generalization. TCRI addresses the limitations of existing domain generalization methods due to incomplete constraints. Specifically, TCRI implements regularizers motivated by conditional independence constraints that are sufficient to strictly learn complete sets of invariant mechanisms, which we show are necessary and sufficient for domain generalization. Empirically, we show that TCRI is effective on both synthetic and real-world data. TCRI is competitive with baselines in average accuracy while outperforming them in worst-domain accuracy, indicating desired cross-domain stability.  ( 2 min )

Deep generative models parametrized up to a normalizing constant (e.g. energy-based models) are difficult to train by maximizing the likelihood of the data because the likelihood and/or gradients thereof cannot be explicitly or efficiently written down. Score matching is a training method, whereby instead of fitting the likelihood $\log p(x)$ for the training data, we instead fit the score function $\nabla_x \log p(x)$ -- obviating the need to evaluate the partition function. Though this estimator is known to be consistent, its unclear whether (and when) its statistical efficiency is comparable to that of maximum likelihood -- which is known to be (asymptotically) optimal. We initiate this line of inquiry in this paper, and show a tight connection between statistical efficiency of score matching and the isoperimetric properties of the distribution being estimated -- i.e. the Poincar\'e, log-Sobolev and isoperimetric constant -- quantities which govern the mixing time of Markov processes like Langevin dynamics. Roughly, we show that the score matching estimator is statistically comparable to the maximum likelihood when the distribution has a small isoperimetric constant. Conversely, if the distribution has a large isoperimetric constant -- even for simple families of distributions like exponential families with rich enough sufficient statistics -- score matching will be substantially less efficient than maximum likelihood. We suitably formalize these results both in the finite sample regime, and in the asymptotic regime. Finally, we identify a direct parallel in the discrete setting, where we connect the statistical properties of pseudolikelihood estimation with approximate tensorization of entropy and the Glauber dynamics.  ( 2 min )

A central challenge of building more powerful Graph Neural Networks (GNNs) is the oversmoothing phenomenon, where increasing the network depth leads to homogeneous node representations and thus worse classification performance. While previous works have only demonstrated that oversmoothing is inevitable when the number of graph convolutions tends to infinity, in this paper, we precisely characterize the mechanism behind the phenomenon via a non-asymptotic analysis. Specifically, we distinguish between two different effects when applying graph convolutions -- an undesirable mixing effect that homogenizes node representations in different classes, and a desirable denoising effect that homogenizes node representations in the same class. By quantifying these two effects on random graphs sampled from the Contextual Stochastic Block Model (CSBM), we show that oversmoothing happens once the mixing effect starts to dominate the denoising effect, and the number of layers required for this transition is $O(\log N/\log (\log N))$ for sufficiently dense graphs with $N$ nodes. We also extend our analysis to study the effects of Personalized PageRank (PPR) on oversmoothing. Our results suggest that while PPR mitigates oversmoothing at deeper layers, PPR-based architectures still achieve their best performance at a shallow depth and are outperformed by the graph convolution approach on certain graphs. Finally, we support our theoretical results with numerical experiments, which further suggest that the oversmoothing phenomenon observed in practice may be exacerbated by the difficulty of optimizing deep GNN models.  ( 2 min )

We develop the theory and algorithmic toolbox for networked federated learning in decentralized collections of local datasets with an intrinsic network structure. This network structure arises from domain-specific notions of similarity between local datasets. Different notions of similarity are induced by spatio-temporal proximity, statistical dependencies or functional relations. Our main conceptual contribution is to formulate networked federated learning using a generalized total variation minimization. This formulation unifies and considerably extends existing federated multi-task learning methods. It is highly flexible and can be combined with a broad range of parametric models including Lasso or deep neural networks. Our main algorithmic contribution is a novel networked federated learning algorithm which is well-suited for distributed computing environments such as edge computing over wireless networks. This algorithm is robust against inexact computations due to limited computational resources. For local models resulting in convex problems, we derive precise conditions on the local models and their network structure such that our algorithm learns nearly optimal local models. Our analysis reveals an interesting interplay between the convex geometry of local models and the (cluster-) geometry of their network structure.  ( 2 min )

Data-driven individualized decision making has recently received increasing research interests. Most existing methods rely on the assumption of no unmeasured confounding, which unfortunately cannot be ensured in practice especially in observational studies. Motivated by the recent proposed proximal causal inference, we develop several proximal learning approaches to estimating optimal individualized treatment regimes (ITRs) in the presence of unmeasured confounding. In particular, we establish several identification results for different classes of ITRs, exhibiting the trade-off between the risk of making untestable assumptions and the value function improvement in decision making. Based on these results, we propose several classification-based approaches to finding a variety of restricted in-class optimal ITRs and develop their theoretical properties. The appealing numerical performance of our proposed methods is demonstrated via an extensive simulation study and one real data application.  ( 2 min )

Over the years, sequential Monte Carlo (SMC) and, equivalently, particle filter (PF) theory has gained substantial attention from researchers. However, the performance of the resampling methodology, also known as offspring selection, has not advanced recently. We propose two deterministic offspring selection methods, which strive to minimize the Kullback-Leibler (KL) divergence and the total variation (TV) distance, respectively, between the particle distribution prior and subsequent to the offspring selection. By reducing the statistical distance between the selected offspring and the joint distribution, we obtain a heuristic search procedure that performs superior to a maximum likelihood search in precisely those contexts where the latter performs better than an SMC. For SMC and particle Markov chain Monte Carlo (pMCMC), our proposed offspring selection methods always outperform or compare favorably with the two state-of-the-art resampling schemes on two models commonly used as benchmarks from the literature.  ( 2 min )

The Optimal transport (OT) problem is rapidly finding its way into machine learning. Favoring its use are its metric properties. Many problems admit solutions with guarantees only for objects embedded in metric spaces, and the use of non-metrics can complicate solving them. Multi-marginal OT (MMOT) generalizes OT to simultaneously transporting multiple distributions. It captures important relations that are missed if the transport only involves two distributions. Research on MMOT, however, has been focused on its existence, uniqueness, practical algorithms, and the choice of cost functions. There is a lack of discussion on the metric properties of MMOT, which limits its theoretical and practical use. Here, we prove new generalized metric properties for a family of pairwise MMOTs. We first explain the difficulty of proving this via two negative results. Afterward, we prove the MMOTs' metric properties. Finally, we show that the generalized triangle inequality of this family of MMOTs cannot be improved. We illustrate the superiority of our MMOTs over other generalized metrics, and over non-metrics in both synthetic and real tasks.  ( 2 min )

Many modern research fields increasingly rely on collecting and analysing massive, often unstructured, and unwieldy datasets. Consequently, there is growing interest in machine learning and artificial intelligence applications that can harness this `data deluge'. This broad nontechnical overview provides a gentle introduction to machine learning with a specific focus on medical and biological applications. We explain the common types of machine learning algorithms and typical tasks that can be solved, illustrating the basics with concrete examples from healthcare. Lastly, we provide an outlook on open challenges, limitations, and potential impacts of machine-learning-powered medicine.  ( 2 min )

With the ever-growing model size and the limited availability of labeled training data, transfer learning has become an increasingly popular approach in many science and engineering domains. For classification problems, this work delves into the mystery of transfer learning through an intriguing phenomenon termed neural collapse (NC), where the last-layer features and classifiers of learned deep networks satisfy: (i) the within-class variability of the features collapses to zero, and (ii) the between-class feature means are maximally and equally separated. Through the lens of NC, our findings for transfer learning are the following: (i) when pre-training models, preventing intra-class variability collapse (to a certain extent) better preserves the intrinsic structures of the input data, so that it leads to better model transferability; (ii) when fine-tuning models on downstream tasks, obtaining features with more NC on downstream data results in better test accuracy on the given task. The above results not only demystify many widely used heuristics in model pre-training (e.g., data augmentation, projection head, self-supervised learning), but also leads to more efficient and principled fine-tuning method on downstream tasks that we demonstrate through extensive experimental results.  ( 2 min )

Prognostication for lung cancer, a leading cause of mortality, remains a complex task, as it needs to quantify the associations of risk factors and health events spanning a patient's entire life. One challenge is that an individual's disease course involves non-terminal (e.g., disease progression) and terminal (e.g., death) events, which form semi-competing relationships. Our motivation comes from the Boston Lung Cancer Study, a large lung cancer survival cohort, which investigates how risk factors influence a patient's disease trajectory. Following developments in the prediction of time-to-event outcomes with neural networks, deep learning has become a focal area for the development of risk prediction methods in survival analysis. However, limited work has been done to predict multi-state or semi-competing risk outcomes, where a patient may experience adverse events such as disease progression prior to death. We propose a novel neural expectation-maximization algorithm to bridge the gap between classical statistical approaches and machine learning. Our algorithm enables estimation of the non-parametric baseline hazards of each state transition, risk functions of predictors, and the degree of dependence among different transitions, via a multi-task deep neural network with transition-specific sub-architectures. We apply our method to the Boston Lung Cancer Study and investigate the impact of clinical and genetic predictors on disease progression and mortality.  ( 2 min )

We study the problem of combining neural networks with symbolic reasoning. Recently introduced frameworks for Probabilistic Neurosymbolic Learning (PNL), such as DeepProbLog, perform exponential-time exact inference, limiting the scalability of PNL solutions. We introduce Approximate Neurosymbolic Inference (A-NeSI): a new framework for PNL that uses neural networks for scalable approximate inference. A-NeSI 1) performs approximate inference in polynomial time without changing the semantics of probabilistic logics; 2) is trained using data generated by the background knowledge; 3) can generate symbolic explanations of predictions; and 4) can guarantee the satisfaction of logical constraints at test time, which is vital in safety-critical applications. Our experiments show that A-NeSI is the first end-to-end method to scale the Multi-digit MNISTAdd benchmark to sums of 15 MNIST digits, up from 4 in competing systems. Finally, our experiments show that A-NeSI achieves explainability and safety without a penalty in performance.  ( 2 min )

Motivated by the human-machine interaction such as training chatbots for improving customer satisfaction, we study human-guided human-machine interaction involving private information. We model this interaction as a two-player turn-based game, where one player (Alice, a human) guides the other player (Bob, a machine) towards a common goal. Specifically, we focus on offline reinforcement learning (RL) in this game, where the goal is to find a policy pair for Alice and Bob that maximizes their expected total rewards based on an offline dataset collected a priori. The offline setting presents two challenges: (i) We cannot collect Bob's private information, leading to a confounding bias when using standard RL methods, and (ii) a distributional mismatch between the behavior policy used to collect data and the desired policy we aim to learn. To tackle the confounding bias, we treat Bob's previous action as an instrumental variable for Alice's current decision making so as to adjust for the unmeasured confounding. We develop a novel identification result and use it to propose a new off-policy evaluation (OPE) method for evaluating policy pairs in this two-player turn-based game. To tackle the distributional mismatch, we leverage the idea of pessimism and use our OPE method to develop an off-policy learning algorithm for finding a desirable policy pair for both Alice and Bob. Finally, we prove that under mild assumptions such as partial coverage of the offline data, the policy pair obtained through our method converges to the optimal one at a satisfactory rate.  ( 2 min )

Linear partial differential equations (PDEs) are an important, widely applied class of mechanistic models, describing physical processes such as heat transfer, electromagnetism, and wave propagation. In practice, specialized numerical methods based on discretization are used to solve PDEs. They generally use an estimate of the unknown model parameters and, if available, physical measurements for initialization. Such solvers are often embedded into larger scientific models or analyses with a downstream application such that error quantification plays a key role. However, by entirely ignoring parameter and measurement uncertainty, classical PDE solvers may fail to produce consistent estimates of their inherent approximation error. In this work, we approach this problem in a principled fashion by interpreting solving linear PDEs as physics-informed Gaussian process (GP) regression. Our framework is based on a key generalization of a widely-applied theorem for conditioning GPs on a finite number of direct observations to observations made via an arbitrary bounded linear operator. Crucially, this probabilistic viewpoint allows to (1) quantify the inherent discretization error; (2) propagate uncertainty about the model parameters to the solution; and (3) condition on noisy measurements. Demonstrating the strength of this formulation, we prove that it strictly generalizes methods of weighted residuals, a central class of PDE solvers including collocation, finite volume, pseudospectral, and (generalized) Galerkin methods such as finite element and spectral methods. This class can thus be directly equipped with a structured error estimate and the capability to incorporate uncertain model parameters and observations. In summary, our results enable the seamless integration of mechanistic models as modular building blocks into probabilistic models.  ( 2 min )

A major challenge when using k-means clustering often is how to choose the parameter k, the number of clusters. In this letter, we want to point out that it is very easy to draw poor conclusions from a common heuristic, the "elbow method". Better alternatives have been known in literature for a long time, and we want to draw attention to some of these easy to use options, that often perform better. This letter is a call to stop using the elbow method altogether, because it severely lacks theoretic support, and we want to encourage educators to discuss the problems of the method -- if introducing it in class at all -- and teach alternatives instead, while researchers and reviewers should reject conclusions drawn from the elbow method.  ( 2 min )

For small training set sizes $P$, the generalization error of wide neural networks is well-approximated by the error of an infinite width neural network (NN), either in the kernel or mean-field/feature-learning regime. However, after a critical sample size $P^*$, we empirically find the finite-width network generalization becomes worse than that of the infinite width network. In this work, we empirically study the transition from infinite-width behavior to this variance limited regime as a function of sample size $P$ and network width $N$. We find that finite-size effects can become relevant for very small dataset sizes on the order of $P^* \sim \sqrt{N}$ for polynomial regression with ReLU networks. We discuss the source of these effects using an argument based on the variance of the NN's final neural tangent kernel (NTK). This transition can be pushed to larger $P$ by enhancing feature learning or by ensemble averaging the networks. We find that the learning curve for regression with the final NTK is an accurate approximation of the NN learning curve. Using this, we provide a toy model which also exhibits $P^* \sim \sqrt{N}$ scaling and has $P$-dependent benefits from feature learning.  ( 2 min )

Due to the subtle balance of intermolecular interactions that govern structure-property relations, predicting the stability of crystal structures formed from molecular building blocks is a highly non-trivial scientific problem. A particularly active and fruitful approach involves classifying the different combinations of interacting chemical moieties, as understanding the relative energetics of different interactions enables the design of molecular crystals and fine-tuning their stabilities. While this is usually performed based on the empirical observation of the most commonly encountered motifs in known crystal structures, we propose to apply a combination of supervised and unsupervised machine-learning techniques to automate the construction of an extensive library of molecular building blocks. We introduce a structural descriptor tailored to the prediction of the binding (lattice) energy and apply it to a curated dataset of organic crystals and exploit its atom-centered nature to obtain a data-driven assessment of the contribution of different chemical groups to the lattice energy of the crystal. We then interpret this library using a low-dimensional representation of the structure-energy landscape and discuss selected examples of the insights into crystal engineering that can be extracted from this analysis, providing a complete database to guide the design of molecular materials.  ( 2 min )

Stochastic Gradient Descent Langevin Dynamics (SGLD) algorithms, which add noise to the classic gradient descent, are known to improve the training of neural networks in some cases where the neural network is very deep. In this paper we study the possibilities of training acceleration for the numerical resolution of stochastic control problems through gradient descent, where the control is parametrized by a neural network. If the control is applied at many discretization times then solving the stochastic control problem reduces to minimizing the loss of a very deep neural network. We numerically show that Langevin algorithms improve the training on various stochastic control problems like hedging and resource management, and for different choices of gradient descent methods.  ( 2 min )

Correlations between factors of variation are prevalent in real-world data. Exploiting such correlations may increase predictive performance on noisy data; however, often correlations are not robust (e.g., they may change between domains, datasets, or applications) and models that exploit them do not generalize when correlations shift. Disentanglement methods aim to learn representations which capture different factors of variation in latent subspaces. A common approach involves minimizing the mutual information between latent subspaces, such that each encodes a single underlying attribute. However, this fails when attributes are correlated. We solve this problem by enforcing independence between subspaces conditioned on the available attributes, which allows us to remove only dependencies that are not due to the correlation structure present in the training data. We achieve this via an adversarial approach to minimize the conditional mutual information (CMI) between subspaces with respect to categorical variables. We first show theoretically that CMI minimization is a good objective for robust disentanglement on linear problems. We then apply our method on real-world datasets based on MNIST and CelebA, and show that it yields models that are disentangled and robust under correlation shift, including in weakly supervised settings.  ( 2 min )

When I first started playing around with ChatGPT, I wanted to know whether, with a bit of human direction and editing, it could write literature. This was my way of telling whether it was good enough to automate most commercial writing. Surprisingly, it works. It by no means writes high literature, but it's good enough for most commercial writing. If you want to check out my project, here's a link to a 3500 word mythological story about the thinking machine Talos, his creation of thinking machines like him, and his quest to overthrow the gods. It took slightly more than an hour to write, edit, and publish. Talos' War Against the Gods submitted by /u/Ancient_Spring2000 [link] [comments]  ( 51 min )

submitted by /u/oridnary_artist [link] [comments]  ( 48 min )

Can you help me sign this petition? https://chng.it/Z6Nf64Q7vc Thanks a lot. submitted by /u/sergiCrack9 [link] [comments]  ( 49 min )

Hey everyone , I think we can all agree that the quality of the major news networks has really taken a nosedive in recent years, so I built an AI system to replace them. Specifically I think today's mainstream media tends to suffer from two problems: Political bias Emotional manipulation to drive outrage and clicks I'm building a system called ANN (artificial news network) to produce balanced, well-researched news stories 24/7. You can see my initial prototype here, which is focused on tech news: Twitter.com/FutureNewsAI It currently is capable of analyzing thousands of news stories per day, compiling balanced investigative reports using AI, automatically generating memes that summarize the articles content, as well as generating AI forecasts of future technologies. Over time I'm going to expand on this functionality significantly until it is the single most reliable source of news across a wide range of topics (business, politics, current events, law, etc.). What kind of stories do y'all want to see be supported by my system? I'm really interested to hear your feedback. submitted by /u/redditguyjustinp [link] [comments]  ( 54 min )

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Hello guys I created a video about dishes for New Year Eve. I was made only with help of AI. Everything like preview, description, video, speech was done with help of AI services. If you're interested in checking out the video, you can find it here: https://youtu.be/lkm5TD6tV1g I hope you enjoy the recipes and have a happy and safe New Year's Eve celebration! submitted by /u/EugenTraveler [link] [comments]  ( 49 min )

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Hi everyone! I have a 300+ page odt file, which I can simply convert to a txt file. On the other hand, I have several dozen scattered notes that I have to insert into this document. I would like to know if there is a software, a library or a project on github (preferably in python) that can help me find the best, most coherent place to insert this note. Alternatively, if you were to create the code from scratch, how would you go about it? submitted by /u/iacoposk8 [link] [comments]  ( 48 min )

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Looking for a good tutorial of creating a basic recommender system using PyTorch, basically have the input be a user and a list of candidate titles and the output be a score (0-1) for each movie for that user. Or anything that explains how to build good user or movie embeddings... Just not finding much high quality stuff, most of the tutorials I've found so far just do data analysis or skip explaining anything complicated and just go straight to "ok that's a good base and you just need to do the rest now" but they don't do it... submitted by /u/Secure-Examination95 [link] [comments]  ( 66 min )

Hey folks, I built TuneMyAI to make it incredibly simple for developers to finetune and deploy Stable Diffusion models to production so they can focus on building great products. As an app developer myself, I spent a while trying to figure out how to go beyond local GPUs and notebooks and setup our own infra using Kubernetes. In summary, we wanted to make it really simple for anyone to build applications on top of Stable Diffusion without worrying about all the MLOps overhead. Our API allows you to finetune your Stable Diffusion models for your specific data sets. We handle everything from storage, finetuning, model deployment & inference and integrate with HuggingFace as well. We're working on a bunch of new features including hosted WebUIs, support for additional models like Whisper and more. Would love for y'all to check us out and share any feedback. You can learn more on ProductHunt. Thanks & Happy Holidays! submitted by /u/TrueBlueDreamin [link] [comments]  ( 65 min )

Paper: https://arxiv.org/abs/2212.10562#google Abstract: Current image generation models struggle to reliably produce well-formed visual text. In this paper, we investigate a key contributing factor: popular text-to-image models lack character-level input features, making it much harder to predict a word's visual makeup as a series of glyphs. To quantify the extent of this effect, we conduct a series of controlled experiments comparing character-aware vs. character-blind text encoders. In the text-only domain, we find that character-aware models provide large gains on a novel spelling task (WikiSpell). Transferring these learnings onto the visual domain, we train a suite of image generation models, and show that character-aware variants outperform their character-blind counterparts across a range of novel text rendering tasks (our DrawText benchmark). Our models set a much higher state-of-the-art on visual spelling, with 30+ point accuracy gains over competitors on rare words, despite training on far fewer examples. https://preview.redd.it/m4ycamclmb8a1.jpg?width=1245&format=pjpg&auto=webp&s=d520e797c1bd7df2f6a60dc820f8066a205a389e https://preview.redd.it/anzemadlmb8a1.jpg?width=1353&format=pjpg&auto=webp&s=1755357041967630d359d50d93527dcb886ad25f https://preview.redd.it/5ikr8gdlmb8a1.jpg?width=1531&format=pjpg&auto=webp&s=1f3c2da40cf96f12122ddb42c0b258f0247550bb https://preview.redd.it/pkhiwnclmb8a1.jpg?width=746&format=pjpg&auto=webp&s=c78b2cc0682252ac86eff1f130189e94dc82c834 https://preview.redd.it/q5l8psclmb8a1.jpg?width=1538&format=pjpg&auto=webp&s=c65a4234f7a0593f2d5f8757b5fe27748be99fd0 submitted by /u/Singularian2501 [link] [comments]  ( 63 min )

Newbie here...so I have a dataset which is stored in mat format. However after loading the file.. it is saved as "dict" and prints numbers in an array. I want to print the images from this dataset. I am stuck at how to move forward from here. I tried googling this… didn’t find any helpful code. Any suggestions will be very helpful! submitted by /u/Turbulent-Complex-25 [link] [comments]  ( 67 min )

Hi everyone! For the 8th (!) year in a row, we have compiled our picks for the most innovative developments in the Python ecosystem. From this edition, we are expanding our list to include not only libraries but also tools that are built to belong in the Python ecosystem — some of which are not written in Python as you’ll see. The full list with expanded descriptions is available here: https://tryolabs.com/blog/2022/12/26/top-python-libraries-2022 As usual, most of the picks have to do with AI / ML. ➡️ Here are our top 10 picks: Ruff — a fast linter python-benedict — a dict on steroids Memray — a memory profiler Codon — a Python compiler using LLVM LangChain — building LLM-powered apps fugue — distributed computing done easy Diffusers — generative AI LineaPy — notebooks in production whylogs — model monitoring Mito — spreadsheet inside notebooks ➕ Plus we added several more to the “long tail” that we hope are useful plus some that we missed last year, so make sure to check out the full post! So: What do you think about our picks? Did we miss any good ones? Please let us know! We take feedback seriously to improve the selection every year 💪🏻 Congrats to the individuals and teams behind each of these libraries. We know open source is hard. Thank you for your invaluable contributions to the Python community! 🚀🚀🚀 submitted by /u/dekked_ [link] [comments]  ( 67 min )

I am working on a unet model that takes as input 64x64 landsat imagery and outputs various classes of agricultural features. The training works ok when I scale the surface reflectance (SR) values to 0-1 (i.e. divide raw SR by the 16bit max constant 65536). What I've noticed is that the model seems to be memorizing the range of values in each image and not learning the shapes and spatial patterns as much. The result is that predictions vary a bit too much from year to year and years not appearing in the training dataset have suboptimal predictions. Batch normalization does not seem to change anything. Model converges faster but the problem remains. What I've tried to do is normalize each image individually by subtracting each channel by its mean and dividing by its standard deviation. This maintains the relative spatial patterns and shapes but bring all images to a mean of 0 and standard deviation of 1. Feeding these normalized images to the model does not work. I get precision and recall of 0. Pretty much all predictions were 0. Is there a reason why this would happen? Am I missing something about the way unet works? Any insight would be appreciated. submitted by /u/skn133229 [link] [comments]  ( 71 min )

Hello everyone, I'm trying to figure out how to apply concepts from SE into ML research. For me it seems like I can find really good settings for my Model and dataset, and it can be reproduced. However, I think there's a better way to create code for experimenting. Fore example, creating and testing baselines, and logging test results seems to be the same between most (if not all) my experiments. I find myself copying and pasting a lot of code snippets between my projects. Yet, every time I try to set down and write a generic code for experimenting. I find that it's either too limiting or impossible for me to write it. I think if I looked into software engineering concepts and principles it might help. I really want to know what was your experience in searching/applying SE into this field, or if you even think it's worth it/possible to. some of my colleagues think it's a waste of time, specially considering that the model would run on completely different code. submitted by /u/sad_potato00 [link] [comments]  ( 68 min )

Hi, I'm dealing with a highly unbalanced binary classification of panel data. I am wondering if there are better ways to estimate the performance of the models than splitting once the dataset at a certain date, since that way I could only obtain a point estimate. I don't think group k-fold is suitable since I'd like to respect the temporal order and I'm unsure if using rolling windows would be a valid strategy. Any opinions? submitted by /u/skagass [link] [comments]  ( 65 min )

Hi, I am using Stochastic Depth in a ResNet based architecture that I train for image classification. I am wondering how does that work out with batchnorm and whether there are some things to know to make it work. To go into details, Stochastic Depth will drop randomly some resnet block and use instead exclusively the shortcut identity connection, effectively reducing the depth of the network during training. Hence, with probability p: x_{n+1} = x_n + f(x_n), with probability (1-p): x_{n+1} = x_n. To preserve the expected values during training and inference, they scale the output of the not-skipped blocks (equation 5 in the paper): x_{n+1} = x_n + f(x_n)/p. That seems logical (even though it does not seem to yield better results in practice but whatever). My question is more related to the variance of the batchs. If one batch contains samples that skip a connection and samples that do not ('row' mode in the Torchvision implementation), even if the values are ajusted to preserve the expected value, the variance will be much higher because we have in practice two distributions (for x_n and x_n + f(x_n)/p), which will mess up with the update of the batch normalization. Also, at inference time, all forward passes will be done as x_{n+1} = x_n + f(x_n), which has a different variance. The torchvision implementation also offers a 'batch' mode that kinda reduce this issue (because the global variance computed this way will be the mean of both distribution variances, instead of the variance of the joint distribution) but it does not seem to be the default mode (it does not even exist in the timm implementation). Has anyone here ever think about it? Is there a specific way to use both stochastic depth and batchnorm ? Thank you. submitted by /u/w2ex [link] [comments]  ( 70 min )

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Tools for getting the job done in machine learning  ( 8 min )

Introduction  ( 11 min )

In the modern era, computers are similar to humans. We can teach them to learn, and make them even to learn on their own. Machine learning…  ( 13 min )

I'm working on training a RL agent for autonomous drone racing (state-based without perception) and I've found three popular options: Airsim Drone Racing (https://github.com/microsoft/AirSim-Drone-Racing-Lab) Flightmare (https://github.com/uzh-rpg/flightmare) Gym-pybullet-drones (https://github.com/utiasDSL/gym-pybullet-drones) Airsim drone racing was used in a Neurips 2019 challenge, but there are some issues with the opengl/Vulkan drivers on modern GPUs. Flightmare was used in this paper, but apprently it uses simplified physics. Does anyone have any experience with these or any other simulators? I want to avoid any surprises later on in the project. submitted by /u/redfedoradog [link] [comments]  ( 57 min )

Hi, I am starting to work on a project related to behaviour cloning on manipulator. For that I need to collect data. Usually people use VR to collect data but I don't have that setup as this is my personal project. So in that case which simulator would be best that allows collection of data through keyboard and mouse. Also if you know any dataset for the manipulator, please mention the link in the comments. submitted by /u/Better-Ad8608 [link] [comments]  ( 60 min )

submitted by /u/DataHack23 [link] [comments]  ( 49 min )

Or would testing the smallest living things with biological neural networks (BNN) against artificial (A)NN with the same number of Neurons be a good way to test ANN vs BNN. For example could a ANN Fly brain survive in a fly simulation or Ant. It's just we often see articles that mention the number of BNN humans have vs the number of ANN an AI has and are we even measuring on the same scale. How do ANN vs BNN compare and what are the main differences? submitted by /u/Arowx [link] [comments]  ( 53 min )

Hi everyone! I have a 300+ page odt file, which I can simply convert to a txt file. On the other hand, I have several dozen scattered notes that I have to insert into this document. I would like to know if there is a software, a library or a project on github (preferably in python) that can help me find the best, most coherent place to insert this note. Alternatively, if you were to create the code from scratch, how would you go about it? submitted by /u/iacoposk8 [link] [comments]  ( 51 min )

Almost all binomial coefficients are divisible by their row number. This is a theorem from [1]. What does it mean? If you iterate through Pascal’s triangle, left-to-right and top-to-bottom, noting which entries C(m, k) are divisible by m, the proportion approaches 1 in the limit. The author proves that the ratio converges to 1, but […] Pascal’s triangle mod row number first appeared on John D. Cook.  ( 5 min )

In last week’s post on polynomial approximations for sine, I showed that the polynomial based on Chebyshev series was much better than a couple alternatives. I calculated a few terms of the Chebyshev series for sin(πx) but didn’t include the calculations in that blog post. I calculated the series coefficients numerically, but this post will […] Chebyshev series for sine first appeared on John D. Cook.  ( 5 min )

3D printing has become one of the most positive advances in tech over the last decade. It offers the ability to create important mechanical parts within minutes. What’s so impressive about this is that it’s also been able to create parts for machinery. That have long been out of service. It has saved money in… Read More »Important 3D printing & Food Technology Innovations The post Important 3D printing & Food Technology Innovations appeared first on Data Science Central.  ( 20 min )

How long does it take the earth to complete one rotation on its axis? The answer depends on your frame of reference. A solar day is the time it takes for the sun to appear at the same position in the sky. A sidereal day is the time it takes for a distant star to […] Solar Day vs Sidereal Day first appeared on John D. Cook.  ( 7 min )

submitted by /u/Ok_Read_2524 [link] [comments]  ( 51 min )

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(If this is the wrong sub I’ll delete it.)But since ai can learn to do things perfectly,could you run multiple ai at once and maybe they will find a bug while trying to optimize the fastest way to beat the game? submitted by /u/CalligrapherSmall241 [link] [comments]  ( 53 min )

In case of complex explanation, I appreciate if you share a YouTube link with the tutorial. submitted by /u/Diogeneselcinico42 [link] [comments]  ( 53 min )

- Images: NightCafe Creator Limited to 10 images / day. Midjourney (Discord server) Limited - Questions: AISEO - Music: SOUNDRAW Do you know of any other tools? submitted by /u/Diogeneselcinico42 [link] [comments]  ( 50 min )

Wrapping up a PhD in philosophy at an ivy school. Work in philosophy of mind (consciousness, perception). Any advice? Anyone know of similar stories? I’m starting to learn some Python, would love to hear any suggestions. submitted by /u/lurkergroove2 [link] [comments]  ( 61 min )

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I do not want to elaborate on the details, but if you would like to discuss the situation privately, let me know. submitted by /u/kstevo06 [link] [comments]  ( 57 min )

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me = is there a chatbot that will output if there is no input after a certain amount of time? ​ you.com = Yes, there are chatbots that can be configured to output a response if there is no input after a certain amount of time. For example, you can use the Timeout trigger in the Chatfuel platform to set a timer that will cause the chatbot to send a message if there is no response from the user within a specified time period. Additionally, some chatbot frameworks, such as Botpress, provide a timeout feature that will cause the chatbot to automatically output a response if there is no user input after a certain amount of time. ​ ​ */ /* or if the user is idle for a certain amount of time */ /* this could be useful to create a chatbot that will keep you from being left alone on your phone */ /* and can also help with keeping an eye out for new people in the area. */ ​ public void run() { ​ System.out.println("Chatbot started"); ​ //create a scanner object Scanner sc = new Scanner(System.in); ​ //create variables to hold input from user and output from chatbot String userInput = "";//holds users input as they type it into the console window, used later in while loop below String botOutput = "";//holds what the bot outputs after processing what was typed by the user, used later in while loop below ​ //while loop runs until quit is typed into console window (userInput) while (!userInput.equalsIgnoreCase("quit")) { ​ //prompts user to enter something into console window (userInput) and stores result in variable called 'input' above, then prints it out so we can see what's going on! :) )0)~/o\_|_/o~(0)/~~\_|_/~~(0)/~~\_|_/~~(0)/~~~~\__|__/~~~~(0)/~~~~~\\__|__/~~~~~\\_(0) submitted by /u/loopy_fun [link] [comments]  ( 53 min )

Hey! ​ For context, I'm blind. I loved video games when I was younger, but can't really play them all that much anymore now that I have lost all eyesight. There are some text based games that I can get into in the way of MUDs, and there are also some fighting games I can play, and a couple games that do have mods which make them fairly playable. ​ While this is great, the selection of games for me to play is extremely low because of this. ​ What I'm imagining though would be game changing for me, and would give me several hours, days, years of enjoyment. I'm thinking of a project that would use a large language model, such as ChatGPT, combined with some sort of sound generation AI, as well as text to speech AI, to create an experience similar to that of a MUD, but full of atmospheric…  ( 60 min )

I get that one can use tile coding to construct features that can then be used with Linar Methods for state-value function approximation (e.g. SGD with linear function approx). But in Sutton and Barto Tile Coding is discussed exclusively in the context of linear methods. What if we were to feed the input layer of a NN not with states, but with features created from states via Tile Coding? I understand that hidden layers of NN are "learning features", but that doesn't automatically imply that feeding the input layer with "crafted" features is pointless. Any thoughts? submitted by /u/m_jochim [link] [comments]  ( 64 min )

I'll admit I don't understand Victorian holiday cards - why would Christmas be best illustrated by a pipe-smoking kangaroo in a dressing gown painting a portrait of a cigar-smoking stork? Or what would lead someone to give their loved ones a card with a crowd of  ( 4 min )

AI Weirdness: the strange side of machine learning  ( 2 min )

Are blacklists actually implemented in these conferences (ICML / ICLR / NeurIPS) given that the number of reviewers required grows every year? submitted by /u/XalosXandrez [link] [comments]  ( 66 min )

Been an industry data scientist for 6 years in fintech and gaming. In fintech, I sensed a need for interpretability and robustness. Also, I was not working with a lot of data(~500k observations to train models). Consequently, I got into the habit of building tree-based models by default, specifically xgboost. Used explainability techniques such as shap to explain models. After moving to online gaming, the scrutiny is less and the scale is far more. I now have the freedom to use deep learning. I need to be able to demonstrate the effectiveness using experiments, but beyond that, do not need explainability at a granular level. Advantages I see with using deep learning- Custom loss functions - basically any differentiable loss function can be trained on. This has huge advantages when the business goal is not aligned with the loss functions out of the box Learning Embeddings - The ability to condense features into dense, latent representations which can be used for any number of use cases Multiple outputs per model - tweaking the architecture See all this, Deep learning seems to offer a lot of advantages, even if the performance might be similar to tree-based methods. What do you guys think? submitted by /u/dhruvnigam93 [link] [comments]  ( 68 min )

Tl;DR: wondering if there's a use case for implementing a sparse layer in the planning step of the network, the rest is just my rambling about my thought process that led me to this question. Trying to code neural networks from scratch as an excercise to understand the whole thing better (background in EE, didn't study ML in undergrad, trying to make sure I understand the entire concept). From what I saw, it seems like a common way to code networks from scratch is to work with layers, basically define a layer as an object holding a matrix of weights and a vector of biases, the object also has has a forward method that gets an input vector multiplies it by the weight matrix adds the biases yadayada... and it has backwards method which gets the gradient vector and outputs a gradient vector…  ( 49 min )

Finding an initial noise vector that produces an input image when fed into the diffusion process (known as inversion) is an important problem in denoising diffusion models (DDMs), with applications for real image editing. The state-of-the-art approach for real image editing with inversion uses denoising diffusion implicit models (DDIMs) to deterministically noise the image to the intermediate state along the path that the denoising would follow given the original conditioning. However, DDIM inversion for real images is unstable as it relies on local linearization assumptions, which result in the propagation of errors, leading to incorrect image reconstruction and loss of content. To alleviate these problems, we propose Exact Diffusion Inversion via Coupled Transformations (EDICT), an inversion method that draws inspiration from affine coupling layers. EDICT enables mathematically exact inversion of real and model-generated images by maintaining two coupled noise vectors which are used to invert each other in an alternating fashion. Using Stable Diffusion, a state-of-the-art latent diffusion model, we demonstrate that EDICT successfully reconstructs real images with high fidelity. On complex image datasets like MS-COCO, EDICT reconstruction significantly outperforms DDIM, improving the mean square error of reconstruction by a factor of two. Using noise vectors inverted from real images, EDICT enables a wide range of image edits--from local and global semantic edits to image stylization--while maintaining fidelity to the original image structure. EDICT requires no model training/finetuning, prompt tuning, or extra data and can be combined with any pretrained DDM. Code is available at https://github.com/salesforce/EDICT.  ( 2 min )

We propose a routing algorithm that takes a sequence of vectors and computes a new sequence with specified length and vector size. Each output vector maximizes "bang per bit," the difference between a net benefit to use and net cost to ignore data, by better predicting the input vectors. We describe output vectors as geometric objects, as latent variables that assign credit, as query states in a model of associative memory, and as agents in a model of a Society of Mind. We implement the algorithm with optimizations that reduce parameter count, computation, and memory use by orders of magnitude, enabling us to route sequences of greater length than previously possible. We evaluate our implementation on natural language and visual classification tasks, obtaining competitive or state-of-the-art accuracy and end-to-end credit assignments that are interpretable.  ( 2 min )

Does anyone have experience in deploying a similar large scale forecasting system? (Assuming enough data is available) How did the final model / system looked like? What ML algorithm was deployed in production? Did one ML model fit on all the data to forecast accurately for all products? Or multiple models were trained specifically for every product/store? What loss function/metrics were used? It will be great to hear your experiences. submitted by /u/k-deeplearning99 [link] [comments]  ( 65 min )

Like AlphaFold, but not in a corporate setting. Even small-data. Does any github 'awesome' list exist for such applied areas being worked upon? submitted by /u/D0ODU [link] [comments]  ( 69 min )

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Any other applications you can think of ? submitted by /u/AImSamy [link] [comments]  ( 64 min )

QDA is a non-linear classification algorithm. However, does its decision boundary always have to be quadratic? I mean if it can produce linear decision boundaries? submitted by /u/Visual-Arm-7375 [link] [comments]  ( 65 min )

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Wondering if any such software exists and if this would be legal in the US to publish using pictures. submitted by /u/Conanzulu [link] [comments]  ( 48 min )

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I started a sub, maybe you'll have something to share. /r/InappropriateAI All in fun, thanks submitted by /u/DropNationalism [link] [comments]  ( 49 min )

What does everyone think of the YouChat bot on You. com search site. You.com, which says it reaches over 1 million actively searching users and has grown over 400% in the last six months . I tested their ChatGPT alternative and found it half-decent. I'm curious as to what others think? The background is You.com, the search engine startup founded in 2020 with a moonshot bid to take on Google, announced today that it has opened its search platform to allow external developers and organizations to build their own apps for the search results page. This includes generative AI apps, it says, that have never been seen inside traditional search engines, using generative AI technology that enables users to generate text (YouWrite), code (YouCode), or images (YouImagine) from plain English — all within the search results page. You can try it out here, let me know if the link works: https://you.com/search?q=who+are+you&tbm=youchat It says: 👋 Hello! My name is YouChat, I’m an AI that can answer general questions, explain things, suggest ideas, translate, summarize text, compose emails, and write code for you. I’m powered by artificial intelligence and natural language processing, allowing you to have human-like conversations with me. I am constantly learning from huge amounts of information on the internet, which means I sometimes may get some answers wrong. My AI is always improving and I will often share sources for my answers. In 2023 there are going to be so many tools like this to be fair paired with Search. submitted by /u/BackgroundResult [link] [comments]  ( 49 min )

How long until we get ChatGPT into Alexa? submitted by /u/TheVellerShow [link] [comments]  ( 49 min )

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I'm fighting the usual existential crisis due to AI and I drown my sorrows with magic mushrooms. Hear me out with this speculation for the future. I think we all agree AI is just getting better. I heard that theory that next generation of startups might be companies that build hyper-specific layers for AI (eg. a law firm building lawyer app). If we keep on this path large models based on curated data, then even if AI gets better it'll stay kinda samey. Plus we might also have a built-in watermark for the generated text. But what if AI being too consistent gets to people. I can see myself reading AI generated emails a few years from now and just seeing at a glance the dry lingo and winding lines of text with minimal meaning. What if people just counter that by being inconsistent, I can see myself adding little flairs to my emails to make sure the reader knows I'm a human. I imagine this is how artists might adapt, if their style is too generic and AI begins to be a major competitor, they might just stylize more. I'd draw parallel between this and zoomer humor. There's just stuff in there I don't find funny, but zoomers do because the goal was to create something they can call their own. So maybe humans adapt by becoming more human, I dunno. I'm still high off mushrooms and just wanted to textualize my thoughts. submitted by /u/Organic_Fudge1041 [link] [comments]  ( 50 min )

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Hey, I think I remember their being SD models that are trainable in a reasonable amount of time. Maybe the trade-off was they are not text conditioned? If that's the case, can you point me toward a keras model or similar? I really want to train my own (from scratch, not transfer learning) and make some modifications. Thank you! submitted by /u/elfballs [link] [comments]  ( 49 min )

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I have been working with Deep RL for a year now. During this time I have learned lots of practical stuff like the importance of reward normalisation or the fact that imposing symmetrical action spaces improves the performance of the continuous models. I would like to know if there is any Deep RL book that focus on these kind of tips for obtaining a good model performance submitted by /u/random-redditor9 [link] [comments]  ( 60 min )

Recently I read many papers on combining Robotics manipulation with natural language processing. In those papers they had used something called Transformer block which uses attention mechanism. They said it is used so that policy can learn to focus on learning what is relevant in the current image frame. I have never used attention block or transformers in general because they are not usually applied to Robotics. Anyone with the experience in using Transformers/Attention, please explain to me if there is any benefit of adding these instead of simple LSTM models. If possible please also explain the structure of the policy neutral networks with a example. submitted by /u/Better-Ad8608 [link] [comments]  ( 62 min )

I was wondering what will be the best baseline RL algorithm for the model-free MDP problem. Currently, I have model-free, off-policy (for adequate exploration), and deterministic policy (restricted to problem formulation) settings in high-dimensional continuous state(dim>millions)/action(dim>hundreds) space. Especially, my environment has a non-stationary state distribution and long episode length (T>3000). However, I just want to see how it does with normal model-free off-policy algorithms first. I've tried Deep Deterministic Policy Gradient, but it doesn't seem to generalize well enough, which giving high train score, while low test score (maybe because of the bad exploration with ornstein-uhlenbeck noise or due to the effect of underlying non-stationary state distribution). I'd really appreciate if you could help me finding some recent model-free algorithms that works well on this types of settings. submitted by /u/g6ssgs [link] [comments]  ( 63 min )

Many natural language related applications involve text generation, created by humans or machines. While in many of those applications machines support humans, yet in few others, (e.g. adversarial machine learning, social bots and trolls) machines try to impersonate humans. In this scope, we proposed and evaluated several mutation-based text generation approaches. Unlike machine-based generated text, mutation-based generated text needs human text samples as inputs. We showed examples of mutation operators but this work can be extended in many aspects such as proposing new text-based mutation operators based on the nature of the application.

The choice of good distances and similarity measures between objects is important for many machine learning methods. Therefore, many metric learning algorithms have been developed in recent years, mainly for Euclidean data in order to improve performance of classification or clustering methods. However, due to difficulties in establishing computable, efficient and differentiable distances between attributed graphs, few metric learning algorithms adapted to graphs have been developed despite the strong interest of the community. In this paper, we address this issue by proposing a new Simple Graph Metric Learning - SGML - model with few trainable parameters based on Simple Graph Convolutional Neural Networks - SGCN - and elements of Optimal Transport theory. This model allows us to build an appropriate distance from a database of labeled (attributed) graphs to improve the performance of simple classification algorithms such as $k$-NN. This distance can be quickly trained while maintaining good performances as illustrated by the experimental study presented in this paper.

We present a generalized balancing method -- stable weights via Neural Gibbs Density -- fully available for estimating causal effects for an arbitrary mixture of discrete and continuous interventions. Our weights are trainable through back-propagation and can be obtained with neural network algorithms. In addition, we also provide a method to measure the performance of our weights by estimating the mutual information for the balanced distribution. Our method is easy to implement with any present deep learning libraries, and the weights from it can be used in most state-of-art supervised algorithms.

Transforming off-the-shelf deep neural network (DNN) models into dynamic multi-exit architectures can achieve inference and transmission efficiency by fragmenting and distributing a large DNN model in edge computing scenarios (e.g., edge devices and cloud servers). In this paper, we propose a novel backdoor attack specifically on the dynamic multi-exit DNN models. Particularly, we inject a backdoor by poisoning one DNN model's shallow hidden layers targeting not this vanilla DNN model but only its dynamically deployed multi-exit architectures. Our backdoored vanilla model behaves normally on performance and cannot be activated even with the correct trigger. However, the backdoor will be activated when the victims acquire this model and transform it into a dynamic multi-exit architecture at their deployment. We conduct extensive experiments to prove the effectiveness of our attack on three structures (ResNet-56, VGG-16, and MobileNet) with four datasets (CIFAR-10, SVHN, GTSRB, and Tiny-ImageNet) and our backdoor is stealthy to evade multiple state-of-the-art backdoor detection or removal methods.

Cooperative multi-agent reinforcement learning (c-MARL) is widely applied in safety-critical scenarios, thus the analysis of robustness for c-MARL models is profoundly important. However, robustness certification for c-MARLs has not yet been explored in the community. In this paper, we propose a novel certification method, which is the first work to leverage a scalable approach for c-MARLs to determine actions with guaranteed certified bounds. c-MARL certification poses two key challenges compared with single-agent systems: (i) the accumulated uncertainty as the number of agents increases; (ii) the potential lack of impact when changing the action of a single agent into a global team reward. These challenges prevent us from directly using existing algorithms. Hence, we employ the false discovery rate (FDR) controlling procedure considering the importance of each agent to certify per-state robustness and propose a tree-search-based algorithm to find a lower bound of the global reward under the minimal certified perturbation. As our method is general, it can also be applied in single-agent environments. We empirically show that our certification bounds are much tighter than state-of-the-art RL certification solutions. We also run experiments on two popular c-MARL algorithms: QMIX and VDN, in two different environments, with two and four agents. The experimental results show that our method produces meaningful guaranteed robustness for all models and environments. Our tool CertifyCMARL is available at https://github.com/TrustAI/CertifyCMA

Variational Autoencoders (VAEs) have recently been highly successful at imputing and acquiring heterogeneous missing data. However, within this specific application domain, existing VAE methods are restricted by using only one layer of latent variables and strictly Gaussian posterior approximations. To address these limitations, we present HH-VAEM, a Hierarchical VAE model for mixed-type incomplete data that uses Hamiltonian Monte Carlo with automatic hyper-parameter tuning for improved approximate inference. Our experiments show that HH-VAEM outperforms existing baselines in the tasks of missing data imputation and supervised learning with missing features. Finally, we also present a sampling-based approach for efficiently computing the information gain when missing features are to be acquired with HH-VAEM. Our experiments show that this sampling-based approach is superior to alternatives based on Gaussian approximations.

Learning the underlying Bayesian Networks (BNs), represented by directed acyclic graphs (DAGs), of the concerned events from purely-observational data is a crucial part of evidential reasoning. This task remains challenging due to the large and discrete search space. A recent flurry of developments followed NOTEARS[1] recast this combinatorial problem into a continuous optimization problem by leveraging an algebraic equality characterization of acyclicity. However, the continuous optimization methods suffer from obtaining non-spare graphs after the numerical optimization, which leads to the inflexibility to rule out the potentially cycle-inducing edges or false discovery edges with small values. To address this issue, in this paper, we develop a completely data-driven DAG structure learning method without a predefined value to post-threshold small values. We name our method NOTEARS with adaptive Lasso (NOTEARS-AL), which is achieved by applying the adaptive penalty method to ensure the sparsity of the estimated DAG. Moreover, we show that NOTEARS-AL also inherits the oracle properties under some specific conditions. Extensive experiments on both synthetic and a real-world dataset verify the efficacy of the proposed method.

Class-imbalanced datasets are known to cause the problem of model being biased towards the majority classes. In this project, we set up two research questions: 1) when is the class-imbalance problem more prevalent in self-supervised pre-training? and 2) can offline clustering of feature representations help pre-training on class-imbalanced data? Our experiments investigate the former question by adjusting the degree of {\it class-imbalance} when training the baseline models, namely SimCLR and SimSiam on CIFAR-10 database. To answer the latter question, we train each expert model on each subset of the feature clusters. We then distill the knowledge of expert models into a single model, so that we will be able to compare the performance of this model to our baselines.

This thesis considers sequential decision problems, where the loss/reward incurred by selecting an action may not be inferred from observed feedback. A major part of this thesis focuses on the unsupervised sequential selection problem, where one can not infer the loss incurred for selecting an action from observed feedback. We also introduce a new setup named Censored Semi Bandits, where the loss incurred for selecting an action can be observed under certain conditions. Finally, we study the channel selection problem in the communication networks, where the reward for an action is only observed when no other player selects that action to play in the round. These problems find applications in many fields like healthcare, crowd-sourcing, security, adaptive resource allocation, among many others. This thesis aims to address the above-described sequential decision problems by exploiting specific structures these problems exhibit. We develop provably optimal algorithms for each of these setups with weak feedback and validate their empirical performance on different problem instances derived from synthetic and real datasets.

In this paper, we propose a large-scale language pre-training for text GENeration using dIffusion modEl, which is named GENIE. GENIE is a pre-training sequence-to-sequence text generation model which combines Transformer and diffusion. The diffusion model accepts the latent information from the encoder, which is used to guide the denoising of the current time step. After multiple such denoise iterations, the diffusion model can restore the Gaussian noise to the diverse output text which is controlled by the input text. Moreover, such architecture design also allows us to adopt large scale pre-training on the GENIE. We propose a novel pre-training method named continuous paragraph denoise based on the characteristics of the diffusion model. Extensive experiments on the XSum, CNN/DailyMail, and Gigaword benchmarks shows that GENIE can achieves comparable performance with various strong baselines, especially after pre-training, the generation quality of GENIE is greatly improved. We have also conduct a lot of experiments on the generation diversity and parameter impact of GENIE. The code for GENIE will be made publicly available.

Automatic lymph node (LN) segmentation and detection for cancer staging are critical. In clinical practice, computed tomography (CT) and positron emission tomography (PET) imaging detect abnormal LNs. Despite its low contrast and variety in nodal size and form, LN segmentation remains a challenging task. Deep convolutional neural networks frequently segment items in medical photographs. Most state-of-the-art techniques destroy image's resolution through pooling and convolution. As a result, the models provide unsatisfactory results. Keeping the issues in mind, a well-established deep learning technique UNet was modified using bilinear interpolation and total generalized variation (TGV) based upsampling strategy to segment and detect mediastinal lymph nodes. The modified UNet maintains texture discontinuities, selects noisy areas, searches appropriate balance points through backpropagation, and recreates image resolution. Collecting CT image data from TCIA, 5-patients, and ELCAP public dataset, a dataset was prepared with the help of experienced medical experts. The UNet was trained using those datasets, and three different data combinations were utilized for testing. Utilizing the proposed approach, the model achieved 94.8% accuracy, 91.9% Jaccard, 94.1% recall, and 93.1% precision on COMBO_3. The performance was measured on different datasets and compared with state-of-the-art approaches. The UNet++ model with hybridized strategy performed better than others.

Localizing anatomical landmarks are important tasks in medical image analysis. However, the landmarks to be localized often lack prominent visual features. Their locations are elusive and easily confused with the background, and thus precise localization highly depends on the context formed by their surrounding areas. In addition, the required precision is usually higher than segmentation and object detection tasks. Therefore, localization has its unique challenges different from segmentation or detection. In this paper, we propose a zoom-in attentive network (ZIAN) for anatomical landmark localization in ocular images. First, a coarse-to-fine, or "zoom-in" strategy is utilized to learn the contextualized features in different scales. Then, an attentive fusion module is adopted to aggregate multi-scale features, which consists of 1) a co-attention network with a multiple regions-of-interest (ROIs) scheme that learns complementary features from the multiple ROIs, 2) an attention-based fusion module which integrates the multi-ROIs features and non-ROI features. We evaluated ZIAN on two open challenge tasks, i.e., the fovea localization in fundus images and scleral spur localization in AS-OCT images. Experiments show that ZIAN achieves promising performances and outperforms state-of-the-art localization methods. The source code and trained models of ZIAN are available at https://github.com/leixiaofeng-astar/OMIA9-ZIAN.

Machine learning (ML) is revolutionizing protein structural analysis, including an important subproblem of predicting protein residue contact maps, i.e., which amino-acid residues are in close spatial proximity given the amino-acid sequence of a protein. Despite recent progresses in ML-based protein contact prediction, predicting contacts with a wide range of distances (commonly classified into short-, medium- and long-range contacts) remains a challenge. Here, we propose a multiscale graph neural network (GNN) based approach taking a cue from multiscale physics simulations, in which a standard pipeline involving a recurrent neural network (RNN) is augmented with three GNNs to refine predictive capability for short-, medium- and long-range residue contacts, respectively. Test results on the ProteinNet dataset show improved accuracy for contacts of all ranges using the proposed multiscale RNN+GNN approach over the conventional approach, including the most challenging case of long-range contact prediction.

Performance metrics-driven context caching has a profound impact on throughput and response time in distributed context management systems for real-time context queries. This paper proposes a reinforcement learning based approach to adaptively cache context with the objective of minimizing the cost incurred by context management systems in responding to context queries. Our novel algorithms enable context queries and sub-queries to reuse and repurpose cached context in an efficient manner. This approach is distinctive to traditional data caching approaches by three main features. First, we make selective context cache admissions using no prior knowledge of the context, or the context query load. Secondly, we develop and incorporate innovative heuristic models to calculate expected performance of caching an item when making the decisions. Thirdly, our strategy defines a time-aware continuous cache action space. We present two reinforcement learning agents, a value function estimating actor-critic agent and a policy search agent using deep deterministic policy gradient method. The paper also proposes adaptive policies such as eviction and cache memory scaling to complement our objective. Our method is evaluated using a synthetically generated load of context sub-queries and a synthetic data set inspired from real world data and query samples. We further investigate optimal adaptive caching configurations under different settings. This paper presents, compares, and discusses our findings that the proposed selective caching methods reach short- and long-term cost- and performance-efficiency. The paper demonstrates that the proposed methods outperform other modes of context management such as redirector mode, and database mode, and cache all policy by up to 60% in cost efficiency.

We address the task of open-world class-agnostic object detection, i.e., detecting every object in an image by learning from a limited number of base object classes. State-of-the-art RGB-based models suffer from overfitting the training classes and often fail at detecting novel-looking objects. This is because RGB-based models primarily rely on appearance similarity to detect novel objects and are also prone to overfitting short-cut cues such as textures and discriminative parts. To address these shortcomings of RGB-based object detectors, we propose incorporating geometric cues such as depth and normals, predicted by general-purpose monocular estimators. Specifically, we use the geometric cues to train an object proposal network for pseudo-labeling unannotated novel objects in the training set. Our resulting Geometry-guided Open-world Object Detector (GOOD) significantly improves detection recall for novel object categories and already performs well with only a few training classes. Using a single "person" class for training on the COCO dataset, GOOD surpasses SOTA methods by 5.0% AR@100, a relative improvement of 24%.

Recurrent neural networks (RNN) are the backbone of many text and speech applications. These architectures are typically made up of several computationally complex components such as; non-linear activation functions, normalization, bi-directional dependence and attention. In order to maintain good accuracy, these components are frequently run using full-precision floating-point computation, making them slow, inefficient and difficult to deploy on edge devices. In addition, the complex nature of these operations makes them challenging to quantize using standard quantization methods without a significant performance drop. We present a quantization-aware training method for obtaining a highly accurate integer-only recurrent neural network (iRNN). Our approach supports layer normalization, attention, and an adaptive piecewise linear (PWL) approximation of activation functions, to serve a wide range of state-of-the-art RNNs. The proposed method enables RNN-based language models to run on edge devices with $2\times$ improvement in runtime, and $4\times$ reduction in model size while maintaining similar accuracy as its full-precision counterpart.  ( 2 min )

Artificial Intelligence (AI) and Machine Learning (ML) are weaving their way into the fabric of society, where they are playing a crucial role in numerous facets of our lives. As we witness the increased deployment of AI and ML in various types of devices, we benefit from their use into energy-efficient algorithms for low powered devices. In this paper, we investigate a scale and medium that is far smaller than conventional devices as we move towards molecular systems that can be utilized to perform machine learning functions, i.e., Molecular Machine Learning (MML). Fundamental to the operation of MML is the transport, processing, and interpretation of information propagated by molecules through chemical reactions. We begin by reviewing the current approaches that have been developed for MML, before we move towards potential new directions that rely on gene regulatory networks inside biological organisms as well as their population interactions to create neural networks. We then investigate mechanisms for training machine learning structures in biological cells based on calcium signaling and demonstrate their application to build an Analog to Digital Converter (ADC). Lastly, we look at potential future directions as well as challenges that this area could solve.  ( 2 min )

t-SNE remains one of the most popular embedding techniques for visualizing high-dimensional data. Most standard packages of t-SNE, such as scikit-learn, use the Barnes-Hut t-SNE (BH t-SNE) algorithm for large datasets. However, existing CPU implementations of this algorithm are inefficient. In this work, we accelerate the BH t-SNE on CPUs via cache optimizations, SIMD, parallelizing sequential steps, and improving parallelization of multithreaded steps. Our implementation (Acc-t-SNE) is up to 261x and 4x faster than scikit-learn and the state-of-the-art BH t-SNE implementation from daal4py, respectively, on a 32-core Intel(R) Icelake cloud instance.

Accurate estimates of the surface solar radiation (SSR) are a prerequisite for intra-day forecasts of solar resources and photovoltaic power generation. Intra-day SSR forecasts are of interest to power traders and to operators of solar plants and power grids who seek to optimize their revenues and maintain the grid stability by matching power supply and demand. Our study analyzes systematic biases and the uncertainty of SSR estimates derived from Meteosat with the SARAH-2 and HelioMont algorithms at intra-hour and intra-day time scales. The satellite SSR estimates are analyzed based on 136 ground stations across altitudes from 200 m to 3570 m Switzerland in 2018. We find major biases and uncertainties in the instantaneous, hourly and daily-mean SSR. In peak daytime periods, the instantaneous satellite SSR deviates from the ground-measured SSR by a mean absolute deviation (MAD) of 110.4 and 99.6 W/m2 for SARAH-2 and HelioMont, respectively. For the daytime SSR, the instantaneous, hourly and daily-mean MADs amount to 91.7, 81.1, 50.8 and 82.5, 66.7, 42.9 W/m2 for SARAH-2 and HelioMont, respectively. Further, the SARAH-2 instantaneous SSR drastically underestimates the solar resources at altitudes above 1000 m in the winter half year. A possible explanation in line with the seasonality of the bias is that snow cover may be misinterpreted as clouds at higher altitudes.

Remote sensing satellites capture the cyclic dynamics of our Planet in regular time intervals recorded in satellite time series data. End-to-end trained deep learning models use this time series data to make predictions at a large scale, for instance, to produce up-to-date crop cover maps. Most time series classification approaches focus on the accuracy of predictions. However, the earliness of the prediction is also of great importance since coming to an early decision can make a crucial difference in time-sensitive applications. In this work, we present an End-to-End Learned Early Classification of Time Series (ELECTS) model that estimates a classification score and a probability of whether sufficient data has been observed to come to an early and still accurate decision. ELECTS is modular: any deep time series classification model can adopt the ELECTS conceptual idea by adding a second prediction head that outputs a probability of stopping the classification. The ELECTS loss function then optimizes the overall model on a balanced objective of earliness and accuracy. Our experiments on four crop classification datasets from Europe and Africa show that ELECTS allows reaching state-of-the-art accuracy while reducing the quantity of data massively to be downloaded, stored, and processed. The source code is available at https://github.com/marccoru/elects.

With the growth of high-dimensional sparse data in web-scale recommender systems, the computational cost to learn high-order feature interaction in CTR prediction task largely increases, which limits the use of high-order interaction models in real industrial applications. Some recent knowledge distillation based methods transfer knowledge from complex teacher models to shallow student models for accelerating the online model inference. However, they suffer from the degradation of model accuracy in knowledge distillation process. It is challenging to balance the efficiency and effectiveness of the shallow student models. To address this problem, we propose a Directed Acyclic Graph Factorization Machine (KD-DAGFM) to learn the high-order feature interactions from existing complex interaction models for CTR prediction via Knowledge Distillation. The proposed lightweight student model DAGFM can learn arbitrary explicit feature interactions from teacher networks, which achieves approximately lossless performance and is proved by a dynamic programming algorithm. Besides, an improved general model KD-DAGFM+ is shown to be effective in distilling both explicit and implicit feature interactions from any complex teacher model. Extensive experiments are conducted on four real-world datasets, including a large-scale industrial dataset from WeChat platform with billions of feature dimensions. KD-DAGFM achieves the best performance with less than 21.5% FLOPs of the state-of-the-art method on both online and offline experiments, showing the superiority of DAGFM to deal with the industrial scale data in CTR prediction task. Our implementation code is available at: https://github.com/RUCAIBox/DAGFM.

Diffusion models have shown a great ability at bridging the performance gap between predictive and generative approaches for speech enhancement. We have shown that they may even outperform their predictive counterparts for non-additive corruption types or when they are evaluated on mismatched conditions. However, diffusion models suffer from a high computational burden, mainly as they require to run a neural network for each reverse diffusion step, whereas predictive approaches only require one pass. As diffusion models are generative approaches they may also produce vocalizing and breathing artifacts in adverse conditions. In comparison, in such difficult scenarios, predictive models typically do not produce such artifacts but tend to distort the target speech instead, thereby degrading the speech quality. In this work, we present a stochastic regeneration approach where an estimate given by a predictive model is provided as a guide for further diffusion. We show that the proposed approach uses the predictive model to remove the vocalizing and breathing artifacts while producing very high quality samples thanks to the diffusion model, even in adverse conditions. We further show that this approach enables to use lighter sampling schemes with fewer diffusion steps without sacrificing quality, thus lifting the computational burden by an order of magnitude. Source code and audio examples are available online (https://uhh.de/inf-sp-storm).  ( 2 min )

Co-clustering is a data mining technique used to extract the underlying block structure between the rows and columns of a data matrix. Many approaches have been studied and have shown their capacity to extract such structures in continuous, binary or contingency tables. However, very little work has been done to perform co-clustering on mixed type data. In this article, we extend the latent block models based co-clustering to the case of mixed data (continuous and binary variables). We then evaluate the effectiveness of the proposed approach on simulated data and we discuss its advantages and potential limits.

Deep Reinforcement Learning is emerging as a promising approach for the continuous control task of robotic arm movement. However, the challenges of learning robust and versatile control capabilities are still far from being resolved for real-world applications, mainly because of two common issues of this learning paradigm: the exploration strategy and the slow learning speed, sometimes known as "the curse of dimensionality". This work aims at exploring and assessing the advantages of the application of Quantum Computing to one of the state-of-art Reinforcement Learning techniques for continuous control - namely Soft Actor-Critic. Specifically, the performance of a Variational Quantum Soft Actor-Critic on the movement of a virtual robotic arm has been investigated by means of digital simulations of quantum circuits. A quantum advantage over the classical algorithm has been found in terms of a significant decrease in the amount of required parameters for satisfactory model training, paving the way for further promising developments.

Model-based attacks can infer training data information from deep neural network models. These attacks heavily depend on the attacker's knowledge of the application domain, e.g., using it to determine the auxiliary data for model-inversion attacks. However, attackers may not know what the model is used for in practice. We propose a generative adversarial network (GAN) based method to explore likely or similar domains of a target model -- the model domain inference (MDI) attack. For a given target (classification) model, we assume that the attacker knows nothing but the input and output formats and can use the model to derive the prediction for any input in the desired form. Our basic idea is to use the target model to affect a GAN training process for a candidate domain's dataset that is easy to obtain. We find that the target model may distract the training procedure less if the domain is more similar to the target domain. We then measure the distraction level with the distance between GAN-generated datasets, which can be used to rank candidate domains for the target model. Our experiments show that the auxiliary dataset from an MDI top-ranked domain can effectively boost the result of model-inversion attacks.  ( 2 min )

Evaluation is the central means for assessing, understanding, and communicating about NLP models. In this position paper, we argue evaluation should be more than that: it is a force for driving change, carrying a sociological and political character beyond its technical dimensions. As a force, evaluation's power arises from its adoption: under our view, evaluation succeeds when it achieves the desired change in the field. Further, by framing evaluation as a force, we consider how it competes with other forces. Under our analysis, we conjecture that the current trajectory of NLP suggests evaluation's power is waning, in spite of its potential for realizing more pluralistic ambitions in the field. We conclude by discussing the legitimacy of this power, who acquires this power and how it distributes. Ultimately, we hope the research community will more aggressively harness evaluation for change.

Autonomous underwater vehicles (AUVs) are regularly used for deep ocean applications. Commonly, the autonomous navigation task is carried out by a fusion between two sensors: the inertial navigation system and the Doppler velocity log (DVL). The DVL operates by transmitting four acoustic beams to the sea floor, and once reflected back, the AUV velocity vector can be estimated. However, in real-life scenarios, such as an uneven seabed, sea creatures blocking the DVL's view and, roll/pitch maneuvers, the acoustic beams' reflection is resulting in a scenario known as DVL outage. Consequently, a velocity update is not available to bind the inertial solution drift. To cope with such situations, in this paper, we leverage our BeamsNet framework and propose a Set-Transformer-based BeamsNet (ST-BeamsNet) that utilizes inertial data readings and previous DVL velocity measurements to regress the current AUV velocity in case of a complete DVL outage. The proposed approach was evaluated using data from experiments held in the Mediterranean Sea with the Snapir AUV and was compared to a moving average (MA) estimator. Our ST-BeamsNet estimated the AUV velocity vector with an 8.547% speed error, which is 26% better than the MA approach.

Heuristic search algorithms, e.g. A*, are the commonly used tools for pathfinding on grids, i.e. graphs of regular structure that are widely employed to represent environments in robotics, video games etc. Instance-independent heuristics for grid graphs, e.g. Manhattan distance, do not take the obstacles into account and, thus, the search led by such heuristics performs poorly in the obstacle-rich environments. To this end, we suggest learning the instance-dependent heuristic proxies that are supposed to notably increase the efficiency of the search. The first heuristic proxy we suggest to learn is the correction factor, i.e. the ratio between the instance independent cost-to-go estimate and the perfect one (computed offline at the training phase). Unlike learning the absolute values of the cost-to-go heuristic function, which was known before, when learning the correction factor the knowledge of the instance-independent heuristic is utilized. The second heuristic proxy is the path probability, which indicates how likely the grid cell is lying on the shortest path. This heuristic can be utilized in the Focal Search framework as the secondary heuristic, allowing us to preserve the guarantees on the bounded sub-optimality of the solution. We learn both suggested heuristics in a supervised fashion with the state-of-the-art neural networks containing attention blocks (transformers). We conduct a thorough empirical evaluation on a comprehensive dataset of planning tasks, showing that the suggested techniques i) reduce the computational effort of the A* up to a factor of $4$x while producing the solutions, which costs exceed the costs of the optimal solutions by less than $0.3$% on average; ii) outperform the competitors, which include the conventional techniques from the heuristic search, i.e. weighted A*, as well as the state-of-the-art learnable planners.

Osteoarthritis (OA) is the most prevalent chronic joint disease worldwide, where knee OA takes more than 80% of commonly affected joints. Knee OA is not a curable disease yet, and it affects large columns of patients, making it costly to patients and healthcare systems. Etiology, diagnosis, and treatment of knee OA might be argued by variability in its clinical and physical manifestations. Although knee OA carries a list of well-known terminology aiming to standardize the nomenclature of the diagnosis, prognosis, treatment, and clinical outcomes of the chronic joint disease, in practice there is a wide range of terminology associated with knee OA across different data sources, including but not limited to biomedical literature, clinical notes, healthcare literacy, and health-related social media. Among these data sources, the scientific articles published in the biomedical literature usually make a principled pipeline to study disease. Rapid yet, accurate text mining on large-scale scientific literature may discover novel knowledge and terminology to better understand knee OA and to improve the quality of knee OA diagnosis, prevention, and treatment. The present works aim to utilize artificial neural network strategies to automatically extract vocabularies associated with knee OA diseases. Our finding indicates the feasibility of developing word embedding neural networks for autonomous keyword extraction and abstraction of knee OA.  ( 2 min )

Low Earth Orbit (LEO) constellations, each comprising a large number of satellites, have become a new source of big data "from the sky". Downloading such data to a ground station (GS) for big data analytics demands very high bandwidth and involves large propagation delays. Federated Learning (FL) offers a promising solution because it allows data to stay in-situ (never leaving satellites) and it only needs to transmit machine learning model parameters (trained on the satellites' data). However, the conventional, synchronous FL process can take several days to train a single FL model in the context of satellite communication (Satcom), due to a bottleneck caused by straggler satellites. In this paper, we propose an asynchronous FL framework for LEO constellations called AsyncFLEO to improve FL efficiency in Satcom. Not only does AsynFLEO address the bottleneck (idle waiting) in synchronous FL, but it also solves the issue of model staleness caused by straggler satellites. AsyncFLEO utilizes high-altitude platforms (HAPs) positioned "in the sky" as parameter servers, and consists of three technical components: (1) a ring-of-stars communication topology, (2) a model propagation algorithm, and (3) a model aggregation algorithm with satellite grouping and staleness discounting. Our extensive evaluation with both IID and non-IID data shows that AsyncFLEO outperforms the state of the art by a large margin, cutting down convergence delay by 22 times and increasing accuracy by 40%.

Adequately assigning credit to actions for future outcomes based on their contributions is a long-standing open challenge in Reinforcement Learning. The assumptions of the most commonly used credit assignment method are disadvantageous in tasks where the effects of decisions are not immediately evident. Furthermore, this method can only evaluate actions that have been selected by the agent, making it highly inefficient. Still, no alternative methods have been widely adopted in the field. Hindsight Credit Assignment is a promising, but still unexplored candidate, which aims to solve the problems of both long-term and counterfactual credit assignment. In this thesis, we empirically investigate Hindsight Credit Assignment to identify its main benefits, and key points to improve. Then, we apply it to factored state representations, and in particular to state representations based on the causal structure of the environment. In this setting, we propose a variant of Hindsight Credit Assignment that effectively exploits a given causal structure. We show that our modification greatly decreases the workload of Hindsight Credit Assignment, making it more efficient and enabling it to outperform the baseline credit assignment method on various tasks. This opens the way to other methods based on given or learned causal structures.

Self-supervised learning (SSL) aims to produce useful feature representations without access to any human-labeled data annotations. Due to the success of recent SSL methods based on contrastive learning, such as SimCLR, this problem has gained popularity. Most current contrastive learning approaches append a parametrized projection head to the end of some backbone network to optimize the InfoNCE objective and then discard the learned projection head after training. This raises a fundamental question: Why is a learnable projection head required if we are to discard it after training? In this work, we first perform a systematic study on the behavior of SSL training focusing on the role of the projection head layers. By formulating the projection head as a parametric component for the InfoNCE objective rather than a part of the network, we present an alternative optimization scheme for training contrastive learning based SSL frameworks. Our experimental study on multiple image classification datasets demonstrates the effectiveness of the proposed approach over alternatives in the SSL literature.

Developed as a solution to a practical need, active learning (AL) methods aim to reduce label complexity and the annotations costs in supervised learning. While recent work has demonstrated the benefit of using AL in combination with large pre-trained language models (PLMs), it has often overlooked the practical challenges that hinder the feasibility of AL in realistic settings. We address these challenges by leveraging representation smoothness analysis to improve the effectiveness of AL. We develop an early stopping technique that does not require a validation set -- often unavailable in realistic AL settings -- and observe significant improvements across multiple datasets and AL methods. Additionally, we find that task adaptation improves AL, whereas standard short fine-tuning in AL does not provide improvements over random sampling. Our work establishes the usefulness of representation smoothness analysis in AL and presents an AL stopping criterion that reduces label complexity.

Hierarchical methods in reinforcement learning have the potential to reduce the amount of decisions that the agent needs to perform when learning new tasks. However, finding a reusable useful temporal abstractions that facilitate fast learning remains a challenging problem. Recently, several deep learning approaches were proposed to learn such temporal abstractions in the form of options in an end-to-end manner. In this work, we point out several shortcomings of these methods and discuss their potential negative consequences. Subsequently, we formulate the desiderata for reusable options and use these to frame the problem of learning options as a gradient-based meta-learning problem. This allows us to formulate an objective that explicitly incentivizes options which allow a higher-level decision maker to adjust in few steps to different tasks. Experimentally, we show that our method is able to learn transferable components which accelerate learning and performs better than existing prior methods developed for this setting. Additionally, we perform ablations to quantify the impact of using gradient-based meta-learning as well as other proposed changes.

With the advent of deep learning application on edge devices, researchers actively try to optimize their deployments on low-power and restricted memory devices. There are established compression method such as quantization, pruning, and architecture search that leverage commodity hardware. Apart from conventional compression algorithms, one may redesign the operations of deep learning models that lead to more efficient implementation. To this end, we propose EuclidNet, a compression method, designed to be implemented on hardware which replaces multiplication, $xw$, with Euclidean distance $(x-w)^2$. We show that EuclidNet is aligned with matrix multiplication and it can be used as a measure of similarity in case of convolutional layers. Furthermore, we show that under various transformations and noise scenarios, EuclidNet exhibits the same performance compared to the deep learning models designed with multiplication operations.  ( 2 min )

Environmental, social and governance (ESG) engagement of companies moved into the focus of public attention over recent years. With the requirements of compulsory reporting being implemented and investors incorporating sustainability in their investment decisions, the demand for transparent and reliable ESG ratings is increasing. However, automatic approaches for forecasting ESG ratings have been quite scarce despite the increasing importance of the topic. In this paper, we build a model to predict ESG ratings from news articles using the combination of multivariate timeseries construction and deep learning techniques. A news dataset for about 3,000 US companies together with their ratings is also created and released for training. Through the experimental evaluation we find out that our approach provides accurate results outperforming the state-of-the-art, and can be used in practice to support a manual determination or analysis of ESG ratings.  ( 2 min )

Microswimmers can acquire information on the surrounding fluid by sensing mechanical queues. They can then navigate in response to these signals. We analyse this navigation by combining deep reinforcement learning with direct numerical simulations to resolve the hydrodynamics. We study how local and non-local information can be used to train a swimmer to achieve particular swimming tasks in a non-uniform flow field, in particular a zig-zag shear flow. The swimming tasks are (1) learning how to swim in the vorticity direction, (2) the shear-gradient direction, and (3) the shear flow direction. We find that access to lab frame information on the swimmer's instantaneous orientation is all that is required in order to reach the optimal policy for (1,2). However, information on both the translational and rotational velocities seem to be required to achieve (3). Inspired by biological microorganisms we also consider the case where the swimmers sense local information, i.e. surface hydrodynamic forces, together with a signal direction. This might correspond to gravity or, for micro-organisms with light sensors, a light source. In this case, we show that the swimmer can reach a comparable level of performance as a swimmer with access to lab frame variables. We also analyse the role of different swimming modes, i.e. pusher, puller, and neutral swimmers.

Recommender systems aim to answer the following question: given the items that a user has interacted with, what items will this user likely interact with next? Historically this problem is often framed as a predictive task via (self-)supervised learning. In recent years, we have seen more emphasis placed on approaching the recommendation problem from a policy optimization perspective: learning a policy that maximizes some reward function (e.g., user engagement). However, it is commonly the case in recommender systems that we are only able to train a new policy given data collected from a previously-deployed policy. The conventional way to address such a policy mismatch is through importance sampling correction, which unfortunately comes with its own limitations. In this paper, we suggest an alternative approach, which involves the use of local policy improvement without off-policy correction. Drawing from a number of related results in the fields of causal inference, bandits, and reinforcement learning, we present a suite of methods that compute and optimize a lower bound of the expected reward of the target policy. Crucially, this lower bound is a function that is easy to estimate from data, and which does not involve density ratios (such as those appearing in importance sampling correction). We argue that this local policy improvement paradigm is particularly well suited for recommender systems, given that in practice the previously-deployed policy is typically of reasonably high quality, and furthermore it tends to be re-trained frequently and gets continuously updated. We discuss some practical recipes on how to apply some of the proposed techniques in a sequential recommendation setting.

The modeling of probability distributions, specifically generative modeling and density estimation, has become an immensely popular subject in recent years by virtue of its outstanding performance on sophisticated data such as images and texts. Nevertheless, a theoretical understanding of its success is still incomplete. One mystery is the paradox between memorization and generalization: In theory, the model is trained to be exactly the same as the empirical distribution of the finite samples, whereas in practice, the trained model can generate new samples or estimate the likelihood of unseen samples. Likewise, the overwhelming diversity of distribution learning models calls for a unified perspective on this subject. This paper provides a mathematical framework such that all the well-known models can be derived based on simple principles. To demonstrate its efficacy, we present a survey of our results on the approximation error, training error and generalization error of these models, which can all be established based on this framework. In particular, the aforementioned paradox is resolved by proving that these models enjoy implicit regularization during training, so that the generalization error at early-stopping avoids the curse of dimensionality. Furthermore, we provide some new results on landscape analysis and the mode collapse phenomenon.

The external visual inspections of rolling stock's underfloor equipment are currently being performed via human visual inspection. In this study, we attempt to partly automate visual inspection by investigating anomaly inspection algorithms that use image processing technology. As the railroad maintenance studies tend to have little anomaly data, unsupervised learning methods are usually preferred for anomaly detection; however, training cost and accuracy is still a challenge. Additionally, a researcher created anomalous images from normal images by adding noise, etc., but the anomalous targeted in this study is the rotation of piping cocks that was difficult to create using noise. Therefore, in this study, we propose a new method that uses style conversion via generative adversarial networks on three-dimensional computer graphics and imitates anomaly images to apply anomaly detection based on supervised learning. The geometry-consistent style conversion model was used to convert the image, and because of this the color and texture of the image were successfully made to imitate the real image while maintaining the anomalous shape. Using the generated anomaly images as supervised data, the anomaly detection model can be easily trained without complex adjustments and successfully detects anomalies.

Quantum machine learning (QML) has received increasing attention due to its potential to outperform classical machine learning methods in various problems. A subclass of QML methods is quantum generative adversarial networks (QGANs) which have been studied as a quantum counterpart of classical GANs widely used in image manipulation and generation tasks. The existing work on QGANs is still limited to small-scale proof-of-concept examples based on images with significant down-scaling. Here we integrate classical and quantum techniques to propose a new hybrid quantum-classical GAN framework. We demonstrate its superior learning capabilities by generating $28 \times 28$ pixels grey-scale images without dimensionality reduction or classical pre/post-processing on multiple classes of the standard MNIST and Fashion MNIST datasets, which achieves comparable results to classical frameworks with 3 orders of magnitude less trainable generator parameters. To gain further insight into the working of our hybrid approach, we systematically explore the impact of its parameter space by varying the number of qubits, the size of image patches, the number of layers in the generator, the shape of the patches and the choice of prior distribution. Our results show that increasing the quantum generator size generally improves the learning capability of the network. The developed framework provides a foundation for future design of QGANs with optimal parameter set tailored for complex image generation tasks.

In recent years the applications of machine learning models have increased rapidly, due to the large amount of available data and technological progress.While some domains like web analysis can benefit from this with only minor restrictions, other fields like in medicine with patient data are strongerregulated. In particular \emph{data privacy} plays an important role as recently highlighted by the trustworthy AI initiative of the EU or general privacy regulations in legislation. Another major challenge is, that the required training \emph{data is} often \emph{distributed} in terms of features or samples and unavailable for classicalbatch learning approaches. In 2016 Google came up with a framework, called \emph{Federated Learning} to solve both of these problems. We provide a brief overview on existing Methods and Applications in the field of vertical and horizontal \emph{Federated Learning}, as well as \emph{Fderated Transfer Learning}.

Information asymmetry in games enables players with the information advantage to manipulate others' beliefs by strategically revealing information to other players. This work considers a double-sided information asymmetry in a Bayesian Stackelberg game, where the leader's realized action, sampled from the mixed strategy commitment, is hidden from the follower. In contrast, the follower holds private information about his payoff. Given asymmetric information on both sides, an important question arises: \emph{Does the leader's information advantage outweigh the follower's?} We answer this question affirmatively in this work, where we demonstrate that by adequately designing a signaling device that reveals partial information regarding the leader's realized action to the follower, the leader can achieve a higher expected utility than that without signaling. Moreover, unlike previous works on the Bayesian Stackelberg game where mathematical programming tools are utilized, we interpret the leader's commitment as a probability measure over the belief space. Such a probabilistic language greatly simplifies the analysis and allows an indirect signaling scheme, leading to a geometric characterization of the equilibrium under the proposed game model.

The paper studies the topological changes from before and after cointegration, for the natural frequencies of the Z24 Bridge. The second natural frequency is known to be nonlinear in temperature, and this will serve as the main focal point of this work. Cointegration is a method of normalising time series data with respect to one another - often strongly-correlated time series. Cointegration is used in this paper to remove effects from Environmental and Operational Variations, by cointegrating the first four natural frequencies for the Z24 Bridge data. The temperature effects on the natural frequency data are clearly visible within the data, and it is desirable, for the purposes of structural health monitoring, that these effects are removed. The univariate time series are embedded in higher-dimensional space, such that interesting topologies are formed. Topological data analysis is used to analyse the raw time series, and the cointegrated equivalents. A standard topological data analysis pipeline is enacted, where simplicial complexes are constructed from the embedded point clouds. Topological properties are then calculated from the simplicial complexes; such as the persistent homology. The persistent homology is then analysed, to determine the topological structure of all the time series.

Machine learning (ML) models are nowadays used in complex applications in various domains, such as medicine, bioinformatics, and other sciences. Due to their black box nature, however, it may sometimes be hard to understand and trust the results they provide. This has increased the demand for reliable visualization tools related to enhancing trust in ML models, which has become a prominent topic of research in the visualization community over the past decades. To provide an overview and present the frontiers of current research on the topic, we present a State-of-the-Art Report (STAR) on enhancing trust in ML models with the use of interactive visualization. We define and describe the background of the topic, introduce a categorization for visualization techniques that aim to accomplish this goal, and discuss insights and opportunities for future research directions. Among our contributions is a categorization of trust against different facets of interactive ML, expanded and improved from previous research. Our results are investigated from different analytical perspectives: (a) providing a statistical overview, (b) summarizing key findings, (c) performing topic analyses, and (d) exploring the data sets used in the individual papers, all with the support of an interactive web-based survey browser. We intend this survey to be beneficial for visualization researchers whose interests involve making ML models more trustworthy, as well as researchers and practitioners from other disciplines in their search for effective visualization techniques suitable for solving their tasks with confidence and conveying meaning to their data.

Recent advances in distributed artificial intelligence (AI) have led to tremendous breakthroughs in various communication services, from fault-tolerant factory automation to smart cities. When distributed learning is run over a set of wirelessly connected devices, random channel fluctuations and the incumbent services running on the same network impact the performance of both distributed learning and the coexisting service. In this paper, we investigate a mixed service scenario where distributed AI workflow and ultra-reliable low latency communication (URLLC) services run concurrently over a network. Consequently, we propose a risk sensitivity-based formulation for device selection to minimize the AI training delays during its convergence period while ensuring that the operational requirements of the URLLC service are met. To address this challenging coexistence problem, we transform it into a deep reinforcement learning problem and address it via a framework based on soft actor-critic algorithm. We evaluate our solution with a realistic and 3GPP-compliant simulator for factory automation use cases. Our simulation results confirm that our solution can significantly decrease the training delay of the distributed AI service while keeping the URLLC availability above its required threshold and close to the scenario where URLLC solely consumes all network resources.  ( 2 min )

This thesis considers sequential decision problems, where the loss/reward incurred by selecting an action may not be inferred from observed feedback. A major part of this thesis focuses on the unsupervised sequential selection problem, where one can not infer the loss incurred for selecting an action from observed feedback. We also introduce a new setup named Censored Semi Bandits, where the loss incurred for selecting an action can be observed under certain conditions. Finally, we study the channel selection problem in the communication networks, where the reward for an action is only observed when no other player selects that action to play in the round. These problems find applications in many fields like healthcare, crowd-sourcing, security, adaptive resource allocation, among many others. This thesis aims to address the above-described sequential decision problems by exploiting specific structures these problems exhibit. We develop provably optimal algorithms for each of these setups with weak feedback and validate their empirical performance on different problem instances derived from synthetic and real datasets.

Few-shot learning (FSL) is a central problem in meta-learning, where learners must efficiently learn from few labeled examples. Within FSL, feature pre-training has recently become an increasingly popular strategy to significantly improve generalization performance. However, the contribution of pre-training is often overlooked and understudied, with limited theoretical understanding of its impact on meta-learning performance. Further, pre-training requires a consistent set of global labels shared across training tasks, which may be unavailable in practice. In this work, we address the above issues by first showing the connection between pre-training and meta-learning. We discuss why pre-training yields more robust meta-representation and connect the theoretical analysis to existing works and empirical results. Secondly, we introduce Meta Label Learning (MeLa), a novel meta-learning algorithm that learns task relations by inferring global labels across tasks. This allows us to exploit pre-training for FSL even when global labels are unavailable or ill-defined. Lastly, we introduce an augmented pre-training procedure that further improves the learned meta-representation. Empirically, MeLa outperforms existing methods across a diverse range of benchmarks, in particular under a more challenging setting where the number of training tasks is limited and labels are task-specific. We also provide extensive ablation study to highlight its key properties.

In this paper, we propose a learning-based framework to simultaneously learn the communication and distributed control policies for a heterogeneous multi-agent system (MAS) under complex mission requirements from Capability Temporal Logic plus (CaTL+) specifications. Both policies are trained, implemented, and deployed using a novel neural network model called CatlNet. Taking advantage of the robustness measure of CaTL+, we train CatlNet centrally to maximize it where network parameters are shared among all agents, allowing CatlNet to scale to large teams easily. CatlNet can then be deployed distributedly. A plan repair algorithm is also introduced to guide CatlNet's training and improve both training efficiency and the overall performance of CatlNet. The CatlNet approach is tested in simulation and results show that, after training, CatlNet can steer the decentralized MAS system online to satisfy a CaTL+ specification with a high success rate.  ( 2 min )

Many applications of reinforcement learning can be formalized as goal-conditioned environments, where, in each episode, there is a "goal" that affects the rewards obtained during that episode but does not affect the dynamics. Various techniques have been proposed to improve performance in goal-conditioned environments, such as automatic curriculum generation and goal relabeling. In this work, we explore a connection between off-policy reinforcement learning in goal-conditioned settings and knowledge distillation. In particular: the current Q-value function and the target Q-value estimate are both functions of the goal, and we would like to train the Q-value function to match its target for all goals. We therefore apply Gradient-Based Attention Transfer (Zagoruyko and Komodakis 2017), a knowledge distillation technique, to the Q-function update. We empirically show that this can improve the performance of goal-conditioned off-policy reinforcement learning when the space of goals is high-dimensional. We also show that this technique can be adapted to allow for efficient learning in the case of multiple simultaneous sparse goals, where the agent can attain a reward by achieving any one of a large set of objectives, all specified at test time. Finally, to provide theoretical support, we give examples of classes of environments where (under some assumptions) standard off-policy algorithms such as DDPG require at least O(d^2) replay buffer transitions to learn an optimal policy, while our proposed technique requires only O(d) transitions, where d is the dimensionality of the goal and state space. Code is available at https://github.com/alevine0/ReenGAGE.

Physics-Informed Neural Networks (PINNs) have gained much attention in various fields of engineering thanks to their capability of incorporating physical laws into the models. PINNs integrate the physical constraints by minimizing the partial differential equations (PDEs) residuals on a set of collocation points. The distribution of these collocation points appears to have a huge impact on the performance of PINNs and the assessment of the sampling methods for these points is still an active topic. In this paper, we propose a Fixed-Budget Online Adaptive Mesh Learning (FBOAML) method, which decomposes the domain into sub-domains, for training collocation points based on local maxima and local minima of the PDEs residuals. The stopping criterion is based on a data set of reference, which leads to an adaptive number of iterations for each specific problem. The effectiveness of FBOAML is demonstrated in the context of non-parameterized and parameterized problems. The impact of the hyper-parameters in FBOAML is investigated in this work. The comparison with other adaptive sampling methods is also illustrated. The numerical results demonstrate important gains in terms of accuracy of PINNs with FBOAML over the classical PINNs with non-adaptive collocation points. We also apply FBOAML in a complex industrial application involving coupling between mechanical and thermal fields. We show that FBOAML is able to identify the high-gradient location and even give better prediction for some physical fields than the classical PINNs with collocation points taken on a pre-adapted finite element mesh.

Iris segmentation is the initial step to identify biometric of animals to establish a traceability system of livestock. In this study, we propose a novel deep learning framework for pixel-wise segmentation with minimum use of annotation labels using BovineAAEyes80 public dataset. In the experiment, U-Net with VGG16 backbone was selected as the best combination of encoder and decoder model, demonstrating a 99.50% accuracy and a 98.35% Dice coefficient score. Remarkably, the selected model accurately segmented corrupted images even without proper annotation data. This study contributes to the advancement of the iris segmentation and the development of a reliable DNNs training framework.

This paper presents a novel approach to the acquisition of language models from corpora. The framework builds on Cobweb, an early system for constructing taxonomic hierarchies of probabilistic concepts that used a tabular, attribute-value encoding of training cases and concepts, making it unsuitable for sequential input like language. In response, we explore three new extensions to Cobweb -- the Word, Leaf, and Path variants. These systems encode each training case as an anchor word and surrounding context words, and they store probabilistic descriptions of concepts as distributions over anchor and context information. As in the original Cobweb, a performance element sorts a new instance downward through the hierarchy and uses the final node to predict missing features. Learning is interleaved with performance, updating concept probabilities and hierarchy structure as classification occurs. Thus, the new approaches process training cases in an incremental, online manner that it very different from most methods for statistical language learning. We examine how well the three variants place synonyms together and keep homonyms apart, their ability to recall synonyms as a function of training set size, and their training efficiency. Finally, we discuss related work on incremental learning and directions for further research.  ( 2 min )

Building a quantum analog of classical deep neural networks represents a fundamental challenge in quantum computing. A key issue is how to address the inherent non-linearity of classical deep learning, a problem in the quantum domain due to the fact that the composition of an arbitrary number of quantum gates, consisting of a series of sequential unitary transformations, is intrinsically linear. This problem has been variously approached in the literature, principally via the introduction of measurements between layers of unitary transformations. In this paper, we introduce the Quantum Path Kernel, a formulation of quantum machine learning capable of replicating those aspects of deep machine learning typically associated with superior generalization performance in the classical domain, specifically, hierarchical feature learning. Our approach generalizes the notion of Quantum Neural Tangent Kernel, which has been used to study the dynamics of classical and quantum machine learning models. The Quantum Path Kernel exploits the parameter trajectory, i.e. the curve delineated by model parameters as they evolve during training, enabling the representation of differential layer-wise convergence behaviors, or the formation of hierarchical parametric dependencies, in terms of their manifestation in the gradient space of the predictor function. We evaluate our approach with respect to variants of the classification of Gaussian XOR mixtures - an artificial but emblematic problem that intrinsically requires multilevel learning in order to achieve optimal class separation.  ( 2 min )

Quantum computing (QC) promises significant advantages on certain hard computational tasks over classical computers. However, current quantum hardware, also known as noisy intermediate-scale quantum computers (NISQ), are still unable to carry out computations faithfully mainly because of the lack of quantum error correction (QEC) capability. A significant amount of theoretical studies have provided various types of QEC codes; one of the notable topological codes is the surface code, and its features, such as the requirement of only nearest-neighboring two-qubit control gates and a large error threshold, make it a leading candidate for scalable quantum computation. Recent developments of machine learning (ML)-based techniques especially the reinforcement learning (RL) methods have been applied to the decoding problem and have already made certain progress. Nevertheless, the device noise pattern may change over time, making trained decoder models ineffective. In this paper, we propose a continual reinforcement learning method to address these decoding challenges. Specifically, we implement double deep Q-learning with probabilistic policy reuse (DDQN-PPR) model to learn surface code decoding strategies for quantum environments with varying noise patterns. Through numerical simulations, we show that the proposed DDQN-PPR model can significantly reduce the computational complexity. Moreover, increasing the number of trained policies can further improve the agent's performance. Our results open a way to build more capable RL agents which can leverage previously gained knowledge to tackle QEC challenges.  ( 2 min )

Accurately predicting the likelihood of interaction between two objects (compound-protein sequence, user-item, author-paper, etc.) is a fundamental problem in Computer Science. Current deep-learning models rely on learning accurate representations of the interacting objects. Importantly, relationships between the interacting objects, or features of the interaction, offer an opportunity to partition the data to create multi-views of the interacting objects. The resulting congruent and non-congruent views can then be exploited via contrastive learning techniques to learn enhanced representations of the objects.  ( 2 min )

We present the Recurrent Interface Network (RIN), a neural net architecture that allocates computation adaptively to the input according to the distribution of information, allowing it to scale to iterative generation of high-dimensional data. Hidden units of RINs are partitioned into the interface, which is locally connected to inputs, and latents, which are decoupled from inputs and can exchange information globally. The RIN block selectively reads from the interface into latents for high-capacity processing, with incremental updates written back to the interface. Stacking multiple blocks enables effective routing across local and global levels. While routing adds overhead, the cost can be amortized in recurrent computation settings where inputs change gradually while more global context persists, such as iterative generation using diffusion models. To this end, we propose a latent self-conditioning technique that "warm-starts" the latents at each iteration of the generation process. When applied to diffusion models operating directly on pixels, RINs yield state-of-the-art image and video generation without cascades or guidance, while being domain-agnostic and up to 10$\times$ more efficient compared to specialized 2D and 3D U-Nets.  ( 2 min )

Cross-modal contrastive learning has led the recent advances in multimodal retrieval with its simplicity and effectiveness. In this work, however, we reveal that cross-modal contrastive learning suffers from incorrect normalization of the sum retrieval probabilities of each text or video instance. Specifically, we show that many test instances are either over- or under-represented during retrieval, significantly hurting the retrieval performance. To address this problem, we propose Normalized Contrastive Learning (NCL) which utilizes the Sinkhorn-Knopp algorithm to compute the instance-wise biases that properly normalize the sum retrieval probabilities of each instance so that every text and video instance is fairly represented during cross-modal retrieval. Empirical study shows that NCL brings consistent and significant gains in text-video retrieval on different model architectures, with new state-of-the-art multimodal retrieval metrics on the ActivityNet, MSVD, and MSR-VTT datasets without any architecture engineering.  ( 2 min )

This paper presents a methodology for integrating machine learning techniques into metaheuristics for solving combinatorial optimization problems. Namely, we propose a general machine learning framework for neighbor generation in metaheuristic search. We first define an efficient neighborhood structure constructed by applying a transformation to a selected subset of variables from the current solution. Then, the key of the proposed methodology is to generate promising neighbors by selecting a proper subset of variables that contains a descent of the objective in the solution space. To learn a good variable selection strategy, we formulate the problem as a classification task that exploits structural information from the characteristics of the problem and from high-quality solutions. We validate our methodology on two metaheuristic applications: a Tabu Search scheme for solving a Wireless Network Optimization problem and a Large Neighborhood Search heuristic for solving Mixed-Integer Programs. The experimental results show that our approach is able to achieve a satisfactory trade-off between the exploration of a larger solution space and the exploitation of high-quality solution regions on both applications.

Retrosynthesis is the task of breaking down a chemical compound recursively step-by-step into molecular precursors until a set of commercially available molecules is found. Consequently, the goal is to provide a valid synthesis route for a molecule. As more single-step models develop, we see increasing accuracy in the prediction of molecular disconnections, potentially improving the creation of synthetic paths. Multi-step approaches repeatedly apply the chemical information stored in single-step retrosynthesis models. However, this connection is not reflected in contemporary research, fixing either the single-step model or the multi-step algorithm in the process. In this work, we establish a bridge between both tasks by benchmarking the performance and transfer of different single-step retrosynthesis models to the multi-step domain by leveraging two common search algorithms, Monte Carlo Tree Search and Retro*. We show that models designed for single-step retrosynthesis, when extended to multi-step, can have a tremendous impact on the route finding capabilities of current multi-step methods, improving performance by up to +30% compared to the most widely used model. Furthermore, we observe no clear link between contemporary single-step and multi-step evaluation metrics, showing that single-step models need to be developed and tested for the multi-step domain and not as an isolated task to find synthesis routes for molecules of interest.  ( 2 min )

Context-sensitive two-point layer 5 pyramidal cells (L5PCs) were discovered as long ago as 1999. However, the potential of this discovery to provide useful neural computation has yet to be demonstrated. Here we show for the first time how a transformative L5PCs-driven deep neural network (DNN), termed the multisensory cooperative computing (MCC) architecture, can effectively process large amounts of heterogeneous real-world audio-visual (AV) data, using far less energy compared to best available 'point' neuron-driven DNNs. A novel highly-distributed parallel implementation on a Xilinx UltraScale+ MPSoC device estimates energy savings up to 245759 $ \times $ 50000 $\mu$J (i.e., 62% less than the baseline model in a semi-supervised learning setup) where a single synapse consumes $8e^{-5}\mu$J. In a supervised learning setup, the energy-saving can potentially reach up to 1250x less (per feedforward transmission) than the baseline model. The significantly reduced neural activity in MCC leads to inherently fast learning and resilience against sudden neural damage. This remarkable performance in pilot experiments demonstrates the embodied neuromorphic intelligence of our proposed cooperative L5PC that receives input from diverse neighbouring neurons as context to amplify the transmission of most salient and relevant information for onward transmission, from overwhelmingly large multimodal information utilised at the early stages of on-chip training. Our proposed approach opens new cross-disciplinary avenues for future on-chip DNN training implementations and posits a radical shift in current neuromorphic computing paradigms.

This project leverages advances in multi-agent reinforcement learning (MARL) to improve the efficiency and flexibility of order-picking systems for commercial warehouses. We envision a warehouse of the future in which dozens of mobile robots and human pickers work together to collect and deliver items within the warehouse. The fundamental problem we tackle, called the order-picking problem, is how these worker agents must coordinate their movement and actions in the warehouse to maximise performance (e.g. order throughput) under given resource constraints. Established industry methods using heuristic approaches require large engineering efforts to optimise for innately variable warehouse configurations. In contrast, the MARL framework can be flexibly applied to any warehouse configuration (e.g. size, layout, number/types of workers, item replenishment frequency) and the agents learn via a process of trial-and-error how to optimally cooperate with one another. This paper details the current status of the R&D effort initiated by Dematic and the University of Edinburgh towards a general-purpose and scalable MARL solution for the order-picking problem in realistic warehouses.

Supervised learning aims to train a classifier under the assumption that training and test data are from the same distribution. To ease the above assumption, researchers have studied a more realistic setting: out-of-distribution (OOD) detection, where test data may come from classes that are unknown during training (i.e., OOD data). Due to the unavailability and diversity of OOD data, good generalization ability is crucial for effective OOD detection algorithms. To study the generalization of OOD detection, in this paper, we investigate the probably approximately correct (PAC) learning theory of OOD detection, which is proposed by researchers as an open problem. First, we find a necessary condition for the learnability of OOD detection. Then, using this condition, we prove several impossibility theorems for the learnability of OOD detection under some scenarios. Although the impossibility theorems are frustrating, we find that some conditions of these impossibility theorems may not hold in some practical scenarios. Based on this observation, we next give several necessary and sufficient conditions to characterize the learnability of OOD detection in some practical scenarios. Lastly, we also offer theoretical supports for several representative OOD detection works based on our OOD theory.

The task we consider is portfolio construction in a speculative market, a fundamental problem in modern finance. While various empirical works now exist to explore deep learning in finance, the theory side is almost non-existent. In this work, we focus on developing a theoretical framework for understanding the use of data augmentation for deep-learning-based approaches to quantitative finance. The proposed theory clarifies the role and necessity of data augmentation for finance; moreover, our theory implies that a simple algorithm of injecting a random noise of strength $\sqrt{|r_{t-1}|}$ to the observed return $r_{t}$ is better than not injecting any noise and a few other financially irrelevant data augmentation techniques.

An autonomous experimentation platform in manufacturing is supposedly capable of conducting a sequential search for finding suitable manufacturing conditions for advanced materials by itself or even for discovering new materials with minimal human intervention. The core of the intelligent control of such platforms is the policy directing sequential experiments, namely, to decide where to conduct the next experiment based on what has been done thus far. Such policy inevitably trades off exploitation versus exploration and the current practice is under the Bayesian optimization framework using the expected improvement criterion or its variants. We discuss whether it is beneficial to trade off exploitation versus exploration by measuring the element and degree of surprise associated with the immediate past observation. We devise a surprise-reacting policy using two existing surprise metrics, known as the Shannon surprise and Bayesian surprise. Our analysis shows that the surprise-reacting policy appears to be better suited for quickly characterizing the overall landscape of a response surface or a design place under resource constraints. We argue that such capability is much needed for futuristic autonomous experimentation platforms. We do not claim that we have a fully autonomous experimentation platform, but believe that our current effort sheds new lights or provides a different view angle as researchers are racing to elevate the autonomy of various primitive autonomous experimentation systems.

The application of Deep Neural Networks (DNNs) to a broad variety of tasks demands methods for coping with the complex and opaque nature of these architectures. When a gold standard is available, performance assessment treats the DNN as a black box and computes standard metrics based on the comparison of the predictions with the ground truth. A deeper understanding of performances requires going beyond such evaluation metrics to diagnose the model behavior and the prediction errors. This goal can be pursued in two complementary ways. On one side, model interpretation techniques "open the box" and assess the relationship between the input, the inner layers and the output, so as to identify the architecture modules most likely to cause the performance loss. On the other hand, black-box error diagnosis techniques study the correlation between the model response and some properties of the input not used for training, so as to identify the features of the inputs that make the model fail. Both approaches give hints on how to improve the architecture and/or the training process. This paper focuses on the application of DNNs to Computer Vision (CV) tasks and presents a survey of the tools that support the black-box performance diagnosis paradigm. It illustrates the features and gaps of the current proposals, discusses the relevant research directions and provides a brief overview of the diagnosis tools in sectors other than CV.

In this article, we present a collection of radio map datasets in dense urban setting, which we generated and made publicly available. The datasets include simulated pathloss/received signal strength (RSS) and time of arrival (ToA) radio maps over a large collection of realistic dense urban setting in real city maps. The two main applications of the presented dataset are 1) learning methods that predict the pathloss from input city maps (namely, deep learning-based simulations), and, 2) wireless localization. The fact that the RSS and ToA maps are computed by the same simulations over the same city maps allows for a fair comparison of the RSS and ToA-based localization methods.  ( 2 min )

Conventional methods for human pose estimation either require a high degree of instrumentation, by relying on many inertial measurement units (IMUs), or constraint the recording space, by relying on extrinsic cameras. These deficits are tackled through the approach of human pose estimation from sparse IMU data. We define attention-oriented adjacency adaptive graph convolutional long-short term memory networks (A3GC-LSTM), to tackle human pose estimation based on six IMUs, through incorporating the human body graph structure directly into the network. The A3GC-LSTM combines both spatial and temporal dependency in a single network operation, more memory efficiently than previous approaches. The recurrent graph learning on arbitrarily long sequences is made possible by equipping graph convolutions with adjacency adaptivity, which eliminates the problem of information loss in deep or recurrent graph networks, while it also allows for learning unknown dependencies between the human body joints. To further boost accuracy, a spatial attention formalism is incorporated into the recurrent LSTM cell. With our presented approach, we are able to utilize the inherent graph nature of the human body, and thus can outperform the state of the art for human pose estimation from sparse IMU data.

MetaFormer, the abstracted architecture of Transformer, has been found to play a significant role in achieving competitive performance. In this paper, we further explore the capacity of MetaFormer, again, without focusing on token mixer design: we introduce several baseline models under MetaFormer using the most basic or common mixers, and summarize our observations as follows: (1) MetaFormer ensures solid lower bound of performance. By merely adopting identity mapping as the token mixer, the MetaFormer model, termed IdentityFormer, achieves >80% accuracy on ImageNet-1K. (2) MetaFormer works well with arbitrary token mixers. When specifying the token mixer as even a random matrix to mix tokens, the resulting model RandFormer yields an accuracy of >81%, outperforming IdentityFormer. Rest assured of MetaFormer's results when new token mixers are adopted. (3) MetaFormer effortlessly offers state-of-the-art results. With just conventional token mixers dated back five years ago, the models instantiated from MetaFormer already beat state of the art. (a) ConvFormer outperforms ConvNeXt. Taking the common depthwise separable convolutions as the token mixer, the model termed ConvFormer, which can be regarded as pure CNNs, outperforms the strong CNN model ConvNeXt. (b) CAFormer sets new record on ImageNet-1K. By simply applying depthwise separable convolutions as token mixer in the bottom stages and vanilla self-attention in the top stages, the resulting model CAFormer sets a new record on ImageNet-1K: it achieves an accuracy of 85.5% at 224x224 resolution, under normal supervised training without external data or distillation. In our expedition to probe MetaFormer, we also find that a new activation, StarReLU, reduces 71% FLOPs of activation compared with GELU yet achieves better performance. We expect StarReLU to find great potential in MetaFormer-like models alongside other neural networks.

Large-scale pretraining instills large amounts of knowledge in deep neural networks. This, in turn, improves the generalization behavior of these models in downstream tasks. What exactly are the limits to the generalization benefits of large-scale pretraining? Here, we report observations from some simple experiments aimed at addressing this question in the context of two semantic parsing tasks involving natural language, SCAN and COGS. We show that language models pretrained exclusively with non-English corpora, or even with programming language corpora, significantly improve out-of-distribution generalization in these benchmarks, compared with models trained from scratch, even though both benchmarks are English-based. This demonstrates the surprisingly broad transferability of pretrained representations and knowledge. Pretraining with a large-scale protein sequence prediction task, on the other hand, mostly deteriorates the generalization performance in SCAN and COGS, suggesting that pretrained representations do not transfer universally and that there are constraints on the similarity between the pretraining and downstream domains for successful transfer. Finally, we show that larger models are harder to train from scratch and their generalization accuracy is lower when trained up to convergence on the relatively small SCAN and COGS datasets, but the benefits of large-scale pretraining become much clearer with larger models.

State-of-the-art causal discovery methods usually assume that the observational data is complete. However, the missing data problem is pervasive in many practical scenarios such as clinical trials, economics, and biology. One straightforward way to address the missing data problem is first to impute the data using off-the-shelf imputation methods and then apply existing causal discovery methods. However, such a two-step method may suffer from suboptimality, as the imputation algorithm may introduce bias for modeling the underlying data distribution. In this paper, we develop a general method, which we call MissDAG, to perform causal discovery from data with incomplete observations. Focusing mainly on the assumptions of ignorable missingness and the identifiable additive noise models (ANMs), MissDAG maximizes the expected likelihood of the visible part of observations under the expectation-maximization (EM) framework. In the E-step, in cases where computing the posterior distributions of parameters in closed-form is not feasible, Monte Carlo EM is leveraged to approximate the likelihood. In the M-step, MissDAG leverages the density transformation to model the noise distributions with simpler and specific formulations by virtue of the ANMs and uses a likelihood-based causal discovery algorithm with directed acyclic graph constraint. We demonstrate the flexibility of MissDAG for incorporating various causal discovery algorithms and its efficacy through extensive simulations and real data experiments.

Sparsely-gated Mixture of Expert (MoE) layers have been recently successfully applied for scaling large transformers, especially for language modeling tasks. An intriguing side effect of sparse MoE layers is that they convey inherent interpretability to a model via natural expert specialization. In this work, we apply sparse MoE layers to CNNs for computer vision tasks and analyze the resulting effect on model interpretability. To stabilize MoE training, we present both soft and hard constraint-based approaches. With hard constraints, the weights of certain experts are allowed to become zero, while soft constraints balance the contribution of experts with an additional auxiliary loss. As a result, soft constraints handle expert utilization better and support the expert specialization process, while hard constraints maintain more generalized experts and increase overall model performance. Our findings demonstrate that experts can implicitly focus on individual sub-domains of the input space. For example, experts trained for CIFAR-100 image classification specialize in recognizing different domains such as flowers or animals without previous data clustering. Experiments with RetinaNet and the COCO dataset further indicate that object detection experts can also specialize in detecting objects of distinct sizes.

Deep Neural Networks (DNNs) have been widely used to perform real-world tasks in cyber-physical systems such as Autonomous Driving Systems (ADS). Ensuring the correct behavior of such DNN-Enabled Systems (DES) is a crucial topic. Online testing is one of the promising modes for testing such systems with their application environments (simulated or real) in a closed loop taking into account the continuous interaction between the systems and their environments. However, the environmental variables (e.g., lighting conditions) that might change during the systems' operation in the real world, causing the DES to violate requirements (safety, functional), are often kept constant during the execution of an online test scenario due to the two major challenges: (1) the space of all possible scenarios to explore would become even larger if they changed and (2) there are typically many requirements to test simultaneously. In this paper, we present MORLOT (Many-Objective Reinforcement Learning for Online Testing), a novel online testing approach to address these challenges by combining Reinforcement Learning (RL) and many-objective search. MORLOT leverages RL to incrementally generate sequences of environmental changes while relying on many-objective search to determine the changes so that they are more likely to achieve any of the uncovered objectives. We empirically evaluate MORLOT using CARLA, a high-fidelity simulator widely used for autonomous driving research, integrated with Transfuser, a DNN-enabled ADS for end-to-end driving. The evaluation results show that MORLOT is significantly more effective and efficient than alternatives with a large effect size. In other words, MORLOT is a good option to test DES with dynamically changing environments while accounting for multiple safety requirements.

This paper presents a game-theoretic framework to study the interactions of attack and defense for deep learning-based NextG signal classification. NextG systems such as the one envisioned for a massive number of IoT devices can employ deep neural networks (DNNs) for various tasks such as user equipment identification, physical layer authentication, and detection of incumbent users (such as in the Citizens Broadband Radio Service (CBRS) band). By training another DNN as the surrogate model, an adversary can launch an inference (exploratory) attack to learn the behavior of the victim model, predict successful operation modes (e.g., channel access), and jam them. A defense mechanism can increase the adversary's uncertainty by introducing controlled errors in the victim model's decisions (i.e., poisoning the adversary's training data). This defense is effective against an attack but reduces the performance when there is no attack. The interactions between the defender and the adversary are formulated as a non-cooperative game, where the defender selects the probability of defending or the defense level itself (i.e., the ratio of falsified decisions) and the adversary selects the probability of attacking. The defender's objective is to maximize its reward (e.g., throughput or transmission success ratio), whereas the adversary's objective is to minimize this reward and its attack cost. The Nash equilibrium strategies are determined as operation modes such that no player can unilaterally improve its utility given the other's strategy is fixed. A fictitious play is formulated for each player to play the game repeatedly in response to the empirical frequency of the opponent's actions. The performance in Nash equilibrium is compared to the fixed attack and defense cases, and the resilience of NextG signal classification against attacks is quantified.  ( 2 min )

Federated learning (FL) is a key enabler for efficient communication and computing, leveraging devices' distributed computing capabilities. However, applying FL in practice is challenging due to the local devices' heterogeneous energy, wireless channel conditions, and non-independently and identically distributed (non-IID) data distributions. To cope with these issues, this paper proposes a novel learning framework by integrating FL and width-adjustable slimmable neural networks (SNN). Integrating FL with SNNs is challenging due to time-varying channel conditions and data distributions. In addition, existing multi-width SNN training algorithms are sensitive to the data distributions across devices, which makes SNN ill-suited for FL. Motivated by this, we propose a communication and energy-efficient SNN-based FL (named SlimFL) that jointly utilizes superposition coding (SC) for global model aggregation and superposition training (ST) for updating local models. By applying SC, SlimFL exchanges the superposition of multiple-width configurations decoded as many times as possible for a given communication throughput. Leveraging ST, SlimFL aligns the forward propagation of different width configurations while avoiding inter-width interference during backpropagation. We formally prove the convergence of SlimFL. The result reveals that SlimFL is not only communication-efficient but also deals with non-IID data distributions and poor channel conditions, which is also corroborated by data-intensive simulations.

We present a fast and numerically accurate method for expanding digitized $L \times L$ images representing functions on $[-1,1]^2$ supported on the disk $\{x \in \mathbb{R}^2 : |x|<1\}$ in the harmonics (Dirichlet Laplacian eigenfunctions) on the disk. Our method, which we refer to as the Fast Disk Harmonics Transform (FDHT), runs in $O(L^2 \log L)$ operations. This basis is also known as the Fourier-Bessel basis, and it has several computational advantages: it is orthogonal, ordered by frequency, and steerable in the sense that images expanded in the basis can be rotated by applying a diagonal transform to the coefficients. Moreover, we show that convolution with radial functions can also be efficiently computed by applying a diagonal transform to the coefficients.

Recovering underlying Directed Acyclic Graph (DAG) structures from observational data is highly challenging due to the combinatorial nature of the DAG-constrained optimization problem. Recently, DAG learning has been cast as a continuous optimization problem by characterizing the DAG constraint as a smooth equality one, generally based on polynomials over adjacency matrices. Existing methods place very small coefficients on high-order polynomial terms for stabilization, since they argue that large coefficients on the higher-order terms are harmful due to numeric exploding. On the contrary, we discover that large coefficients on higher-order terms are beneficial for DAG learning, when the spectral radiuses of the adjacency matrices are small, and that larger coefficients for higher-order terms can approximate the DAG constraints much better than the small counterparts. Based on this, we propose a novel DAG learning method with efficient truncated matrix power iteration to approximate geometric series based DAG constraints. Empirically, our DAG learning method outperforms the previous state-of-the-arts in various settings, often by a factor of $3$ or more in terms of structural Hamming distance.

Despite a sea of interpretability methods that can produce plausible explanations, the field has also empirically seen many failure cases of such methods. In light of these results, it remains unclear for practitioners how to use these methods and choose between them in a principled way. In this paper, we show that for even moderately rich model classes (easily satisfied by neural networks), any feature attribution method that is complete and linear--for example, Integrated Gradients and SHAP--can provably fail to improve on random guessing for inferring model behaviour. Our results apply to common end-tasks such as identifying local model behaviour, spurious feature identification, and algorithmic recourse. One takeaway from our work is the importance of concretely defining end-tasks. In particular, we show that once such an end-task is defined, a simple and direct approach of repeated model evaluations can outperform many other complex feature attribution methods.  ( 2 min )

Although theoretical properties such as expressive power and over-smoothing of graph neural networks (GNN) have been extensively studied recently, its convergence property is a relatively new direction. In this paper, we investigate the convergence of one powerful GNN, Invariant Graph Network (IGN) over graphs sampled from graphons. We first prove the stability of linear layers for general $k$-IGN (of order $k$) based on a novel interpretation of linear equivariant layers. Building upon this result, we prove the convergence of $k$-IGN under the model of \citet{ruiz2020graphon}, where we access the edge weight but the convergence error is measured for graphon inputs. Under the more natural (and more challenging) setting of \citet{keriven2020convergence} where one can only access 0-1 adjacency matrix sampled according to edge probability, we first show a negative result that the convergence of any IGN is not possible. We then obtain the convergence of a subset of IGNs, denoted as IGN-small, after the edge probability estimation. We show that IGN-small still contains function class rich enough that can approximate spectral GNNs arbitrarily well. Lastly, we perform experiments on various graphon models to verify our statements.

Link-adaptation (LA) is one of the most important aspects of wireless communications where the modulation and coding scheme (MCS) used by the transmitter is adapted to the channel conditions in order to meet a certain target error-rate. In a single-user SISO (SU-SISO) system with out-of-cell interference, LA is performed by computing the post-equalization signal-to-interference-noise ratio (SINR) at the receiver. The same technique can be employed in multi-user MIMO (MU-MIMO) receivers that use linear detectors. Another important use of post-equalization SINR is for physical layer (PHY) abstraction, where several PHY blocks like the channel encoder, the detector, and the channel decoder are replaced by an abstraction model in order to speed up system-level simulations. However, for MU-MIMO systems with non-linear receivers, there is no known equivalent of post-equalization SINR which makes both LA and PHY abstraction extremely challenging. This important issue is addressed in this two-part paper. In this part, a metric called the bit-metric decoding rate (BMDR) of a detector, which is the proposed equivalent of post-equalization SINR, is presented. Since BMDR does not have a closed form expression that would enable its instantaneous calculation, a machine-learning approach to predict it is presented along with extensive simulation results.

3D deep learning is a growing field of interest due to the vast amount of information stored in 3D formats. Triangular meshes are an efficient representation for irregular, non-uniform 3D objects. However, meshes are often challenging to annotate due to their high geometrical complexity. Specifically, creating segmentation masks for meshes is tedious and time-consuming. Therefore, it is desirable to train segmentation networks with limited-labeled data. Self-supervised learning (SSL), a form of unsupervised representation learning, is a growing alternative to fully-supervised learning which can decrease the burden of supervision for training. We propose SSL-MeshCNN, a self-supervised contrastive learning method for pre-training CNNs for mesh segmentation. We take inspiration from traditional contrastive learning frameworks to design a novel contrastive learning algorithm specifically for meshes. Our preliminary experiments show promising results in reducing the heavy labeled data requirement needed for mesh segmentation by at least 33%.

A statistical ensemble of neural networks can be described in terms of a quantum field theory (NN-QFT correspondence). The infinite-width limit is mapped to a free field theory, while finite N corrections are mapped to interactions. After reviewing the correspondence, we will describe how to implement renormalization in this context and discuss preliminary numerical results for translation-invariant kernels. A major outcome is that changing the standard deviation of the neural network weight distribution corresponds to a renormalization flow in the space of networks.  ( 2 min )

Machine learning applications have become ubiquitous. Their applications range from embedded control in production machines over process optimization in diverse areas (e.g., traffic, finance, sciences) to direct user interactions like advertising and recommendations. This has led to an increased effort of making machine learning trustworthy. Explainable and fair AI have already matured. They address the knowledgeable user and the application engineer. However, there are users that want to deploy a learned model in a similar way as their washing machine. These stakeholders do not want to spend time in understanding the model, but want to rely on guaranteed properties. What are the relevant properties? How can they be expressed to the stakeholder without presupposing machine learning knowledge? How can they be guaranteed for a certain implementation of a machine learning model? These questions move far beyond the current state of the art and we want to address them here. We propose a unified framework that certifies learning methods via care labels. They are easy to understand and draw inspiration from well-known certificates like textile labels or property cards of electronic devices. Our framework considers both, the machine learning theory and a given implementation. We test the implementation's compliance with theoretical properties and bounds.

We propose an end-to-end framework to measure people's vital signs including Heart Rate (HR), Heart Rate Variability (HRV), Oxygen Saturation (SpO2) and Blood Pressure (BP) based on the rPPG methodology from the video of a user's face captured with a smartphone camera. We extract face landmarks with a deep learning-based neural network model in real-time. Multiple face patches also called Regions-of-Interest (RoIs) are extracted by using the predicted face landmarks. Several filters are applied to reduce the noise from the RoIs in the extracted cardiac signals called Blood Volume Pulse (BVP) signal. The measurements of HR, HRV and SpO2 are validated on two public rPPG datasets namely the TokyoTech rPPG and the Pulse Rate Detection (PURE) datasets, on which our models achieved the following Mean Absolute Errors (MAE): a) for HR, 1.73Beats-Per-Minute (bpm) and 3.95bpm respectively; b) for HRV, 18.55ms and 25.03ms respectively, and c) for SpO2, an MAE of 1.64% on the PURE dataset. We validated our end-to-end rPPG framework, ReViSe, in daily living environment, and thereby created the Video-HR dataset. Our HR estimation model achieved an MAE of 2.49bpm on this dataset. Since no publicly available rPPG datasets existed for BP measurement with face videos, we used a dataset with signals from fingertip sensor to train our deep learning-based BP estimation model and also created our own video dataset, Video-BP. On our Video-BP dataset, our BP estimation model achieved an MAE of 6.7mmHg for Systolic Blood Pressure (SBP), and an MAE of 9.6mmHg for Diastolic Blood Pressure (DBP). ReViSe framework has been validated on datasets with videos recorded in daily living environment as opposed to less noisy laboratory environment as reported by most state-of-the-art techniques.

We present a new algorithm for automatically bounding the Taylor remainder series. In the special case of a scalar function $f: \mathbb{R} \mapsto \mathbb{R}$, our algorithm takes as input a reference point $x_0$, trust region $[a, b]$, and integer $k \ge 0$, and returns an interval $I$ such that $f(x) - \sum_{i=0}^k \frac {f^{(i)}(x_0)} {i!} (x - x_0)^i \in I (x - x_0)^{k+1}$ for all $x \in [a, b]$. As in automatic differentiation, the function $f$ is provided to the algorithm in symbolic form, and must be composed of known elementary functions. At a high level, our algorithm has two steps. First, for a variety of commonly-used elementary functions (e.g., $\exp$, $\log$), we derive sharp polynomial upper and lower bounds on the Taylor remainder series. We then recursively combine the bounds for the elementary functions using an interval arithmetic variant of Taylor-mode automatic differentiation. Our algorithm can make efficient use of machine learning hardware accelerators, and we provide an open source implementation in JAX. We then turn our attention to applications. Most notably, we use our new machinery to create the first universal majorization-minimization optimization algorithms: algorithms that iteratively minimize an arbitrary loss using a majorizer that is derived automatically, rather than by hand. Applied to machine learning, this leads to architecture-specific optimizers for training deep networks that converge from any starting point, without hyperparameter tuning. Our experiments show that for some optimization problems, these hyperparameter-free optimizers outperform tuned versions of gradient descent, Adam, and AdaGrad. We also show that our automatically-derived bounds can be used for verified global optimization and numerical integration, and to prove sharper versions of Jensen's inequality.

Co-clustering is a class of unsupervised data analysis techniques that extract the existing underlying dependency structure between the instances and variables of a data table as homogeneous blocks. Most of those techniques are limited to variables of the same type. In this paper, we propose a mixed data co-clustering method based on a two-step methodology. In the first step, all the variables are binarized according to a number of bins chosen by the analyst, by equal frequency discretization in the numerical case, or keeping the most frequent values in the categorical case. The second step applies a co-clustering to the instances and the binary variables, leading to groups of instances and groups of variable parts. We apply this methodology on several data sets and compare with the results of a Multiple Correspondence Analysis applied to the same data.

Deep image prior (DIP) has recently attracted attention owing to its unsupervised positron emission tomography (PET) image reconstruction, which does not require any prior training dataset. In this paper, we present the first attempt to implement an end-to-end DIP-based fully 3D PET image reconstruction method that incorporates a forward-projection model into a loss function. To implement a practical fully 3D PET image reconstruction, which could not be performed due to a graphics processing unit memory limitation, we modify the DIP optimization to block-iteration and sequentially learn an ordered sequence of block sinograms. Furthermore, the relative difference penalty (RDP) term was added to the loss function to enhance the quantitative PET image accuracy. We evaluated our proposed method using Monte Carlo simulation with [$^{18}$F]FDG PET data of a human brain and a preclinical study on monkey brain [$^{18}$F]FDG PET data. The proposed method was compared with the maximum-likelihood expectation maximization (EM), maximum-a-posterior EM with RDP, and hybrid DIP-based PET reconstruction methods. The simulation results showed that the proposed method improved the PET image quality by reducing statistical noise and preserved a contrast of brain structures and inserted tumor compared with other algorithms. In the preclinical experiment, finer structures and better contrast recovery were obtained by the proposed method. This indicated that the proposed method can produce high-quality images without a prior training dataset. Thus, the proposed method is a key enabling technology for the straightforward and practical implementation of end-to-end DIP-based fully 3D PET image reconstruction.

Computational cost of training state-of-the-art deep models in many learning problems is rapidly increasing due to more sophisticated models and larger datasets. A recent promising direction for reducing training cost is dataset condensation that aims to replace the original large training set with a significantly smaller learned synthetic set while preserving the original information. While training deep models on the small set of condensed images can be extremely fast, their synthesis remains computationally expensive due to the complex bi-level optimization and second-order derivative computation. In this work, we propose a simple yet effective method that synthesizes condensed images by matching feature distributions of the synthetic and original training images in many sampled embedding spaces. Our method significantly reduces the synthesis cost while achieving comparable or better performance. Thanks to its efficiency, we apply our method to more realistic and larger datasets with sophisticated neural architectures and obtain a significant performance boost. We also show promising practical benefits of our method in continual learning and neural architecture search.

Feature acquisition algorithms address the problem of acquiring informative features while balancing the costs of acquisition to improve the learning performances of ML models. Previous approaches have focused on calculating the expected utility values of features to determine the acquisition sequences. Other approaches formulated the problem as a Markov Decision Process (MDP) and applied reinforcement learning based algorithms. In comparison to previous approaches, we focus on 1) formulating the feature acquisition problem as a MDP and applying Monte Carlo Tree Search, 2) calculating the intermediary rewards for each acquisition step based on model improvements and acquisition costs and 3) simultaneously optimizing model improvement and acquisition costs with multi-objective Monte Carlo Tree Search. With Proximal Policy Optimization and Deep Q-Network algorithms as benchmark, we show the effectiveness of our proposed approach with experimental study.  ( 2 min )

The quantum machine learning (QML) paradigms and their synergies with network slicing can be envisioned to be a disruptive technology on the cusp of entering to era of sixth-generation (6G), where the mobile communication systems are underpinned in the form of advanced tenancy-based digital use-cases to meet different service requirements. To overcome the challenges of massive slices such as handling the increased dynamism, heterogeneity, amount of data, extended training time, and variety of security levels for slice instances, the power of quantum computing pursuing a distributed computation and learning can be deemed as a promising prerequisite. In this intent, we propose a cloud-native federated learning framework based on quantum deep reinforcement learning (QDRL) where distributed decision agents deployed as micro-services at the edge and cloud through Kubernetes infrastructure then are connected dynamically to the radio access network (RAN). Specifically, the decision agents leverage the remold of classical deep reinforcement learning (DRL) algorithm into variational quantum circuits (VQCs) to obtain the optimal cooperative control on slice resources. The initial numerical results show that the proposed federated QDRL (FQDRL) scheme provides comparable performance than benchmark solutions and reveals the quantum advantage in parameter reduction. To the best of our knowledge, this is the first exploratory study considering an FQDRL approach for 6G communication network.  ( 2 min )

Testing Deep Learning (DL) based systems inherently requires large and representative test sets to evaluate whether DL systems generalise beyond their training datasets. Diverse Test Input Generators (TIGs) have been proposed to produce artificial inputs that expose issues of the DL systems by triggering misbehaviours. Unfortunately, such generated inputs may be invalid, i.e., not recognisable as part of the input domain, thus providing an unreliable quality assessment. Automated validators can ease the burden of manually checking the validity of inputs for human testers, although input validity is a concept difficult to formalise and, thus, automate. In this paper, we investigate to what extent TIGs can generate valid inputs, according to both automated and human validators. We conduct a large empirical study, involving 2 different automated validators, 220 human assessors, 5 different TIGs and 3 classification tasks. Our results show that 84% artificially generated inputs are valid, according to automated validators, but their expected label is not always preserved. Automated validators reach a good consensus with humans (78% accuracy), but still have limitations when dealing with feature-rich datasets.  ( 2 min )

For satellite images, the presence of clouds presents a problem as clouds obscure more than half to two-thirds of the ground information. This problem causes many issues for reliability in a noise-free environment to communicate data and other applications that need seamless monitoring. Removing the clouds from the images while keeping the background pixels intact can help address the mentioned issues. Recently, deep learning methods have become popular for researching cloud removal by demonstrating promising results, among which Generative Adversarial Networks (GAN) have shown considerably better performance. In this project, we aim to address cloud removal from satellite images using AttentionGAN and then compare our results by reproducing the results obtained using traditional GANs and auto-encoders. We use RICE dataset. The outcome of this project can be used to develop applications that require cloud-free satellite images. Moreover, our results could be helpful for making further research improvements.  ( 2 min )

The ultimate goal of artificial intelligence is to mimic the human brain to perform decision-making and control directly from high-dimensional sensory input. All-optical diffractive neural networks provide a promising solution for realizing artificial intelligence with high-speed and low-power consumption. To date, most of the reported diffractive neural networks focus on single or multiple tasks that do not involve interaction with the environment, such as object recognition and image classification, while the networks that can perform decision-making and control, to our knowledge, have not been developed yet. Here, we propose to use deep reinforcement learning to realize diffractive neural networks that enable imitating the human-level capability of decision-making and control. Such networks allow for finding optimal control policies through interaction with the environment and can be readily realized with the dielectric metasurfaces. The superior performances of these networks are verified by engaging three types of classic games, Tic-Tac-Toe, Super Mario Bros., and Car Racing, and achieving the same or even higher levels comparable to human players. Our work represents a solid step of advancement in diffractive neural networks, which promises a fundamental shift from the target-driven control of a pre-designed state for simple recognition or classification tasks to the high-level sensory capability of artificial intelligence. It may find exciting applications in autonomous driving, intelligent robots, and intelligent manufacturing.  ( 2 min )

Human motion prediction is a complex task as it involves forecasting variables over time on a graph of connected sensors. This is especially true in the case of few-shot learning, where we strive to forecast motion sequences for previously unseen actions based on only a few examples. Despite this, almost all related approaches for few-shot motion prediction do not incorporate the underlying graph, while it is a common component in classical motion prediction. Furthermore, state-of-the-art methods for few-shot motion prediction are restricted to motion tasks with a fixed output space meaning these tasks are all limited to the same sensor graph. In this work, we propose to extend recent works on few-shot time-series forecasting with heterogeneous attributes with graph neural networks to introduce the first few-shot motion approach that explicitly incorporates the spatial graph while also generalizing across motion tasks with heterogeneous sensors. In our experiments on motion tasks with heterogeneous sensors, we demonstrate significant performance improvements with lifts from 10.4% up to 39.3% compared to best state-of-the-art models. Moreover, we show that our model can perform on par with the best approach so far when evaluating on tasks with a fixed output space while maintaining two magnitudes fewer parameters.  ( 2 min )

Market sentiment analysis on social media content requires knowledge of both financial markets and social media jargon, which makes it a challenging task for human raters. The resulting lack of high-quality labeled data stands in the way of conventional supervised learning methods. Instead, we approach this problem using semi-supervised learning with a large language model (LLM). Our pipeline generates weak financial sentiment labels for Reddit posts with an LLM and then uses that data to train a small model that can be served in production. We find that prompting the LLM to produce Chain-of-Thought summaries and forcing it through several reasoning paths helps generate more stable and accurate labels, while using a regression loss further improves distillation quality. With only a handful of prompts, the final model performs on par with existing supervised models. Though production applications of our model are limited by ethical considerations, the model's competitive performance points to the great potential of using LLMs for tasks that otherwise require skill-intensive annotation.  ( 2 min )

State-of-the-art object detectors are treated as black boxes due to their highly non-linear internal computations. Even with unprecedented advancements in detector performance, the inability to explain how their outputs are generated limits their use in safety-critical applications. Previous work fails to produce explanations for both bounding box and classification decisions, and generally make individual explanations for various detectors. In this paper, we propose an open-source Detector Explanation Toolkit (DExT) which implements the proposed approach to generate a holistic explanation for all detector decisions using certain gradient-based explanation methods. We suggests various multi-object visualization methods to merge the explanations of multiple objects detected in an image as well as the corresponding detections in a single image. The quantitative evaluation show that the Single Shot MultiBox Detector (SSD) is more faithfully explained compared to other detectors regardless of the explanation methods. Both quantitative and human-centric evaluations identify that SmoothGrad with Guided Backpropagation (GBP) provides more trustworthy explanations among selected methods across all detectors. We expect that DExT will motivate practitioners to evaluate object detectors from the interpretability perspective by explaining both bounding box and classification decisions.  ( 2 min )

Dose verification based on proton-induced positron emitters is a promising quality assurance tool and may leverage the strength of artificial intelligence. To move a step closer towards practical application, the sensitivity analysis of two factors needs to be performed: biological washout and depth selection. selection. A bi-directional recurrent neural network (RNN) model was developed. The training dataset was generated based upon a CT image-based phantom (abdomen region) and multiple beam energies/pathways, using Monte-Carlo simulation (1 mm spatial resolution, no biological washout). For the modeling of biological washout, a simplified analytical model was applied to change raw activity profiles over a period of 5 minutes, incorporating both physical decay and biological washout. For the study of depth selection (a challenge linked to multi field/angle irradiation), truncations were applied at different window lengths (100, 125, 150 mm) to raw activity profiles. Finally, the performance of a worst-case scenario was examined by combining both factors (depth selection: 125 mm, biological washout: 5 mins). The accuracy was quantitatively evaluated in terms of range uncertainty, mean absolute error (MAE) and mean relative errors (MRE). Our proposed AI framework shows good immunity to the perturbation associated with two factors. The detection of proton-induced positron emitters, combined with machine learning, has great potential to implement online patient-specific verification in proton therapy.  ( 2 min )

Objective: Accurate visual classification of bladder tissue during Trans-Urethral Resection of Bladder Tumor (TURBT) procedures is essential to improve early cancer diagnosis and treatment. During TURBT interventions, White Light Imaging (WLI) and Narrow Band Imaging (NBI) techniques are used for lesion detection. Each imaging technique provides diverse visual information that allows clinicians to identify and classify cancerous lesions. Computer vision methods that use both imaging techniques could improve endoscopic diagnosis. We address the challenge of tissue classification when annotations are available only in one domain, in our case WLI, and the endoscopic images correspond to an unpaired dataset, i.e. there is no exact equivalent for every image in both NBI and WLI domains. Method: We propose a semi-surprised Generative Adversarial Network (GAN)-based method composed of three main components: a teacher network trained on the labeled WLI data; a cycle-consistency GAN to perform unpaired image-to-image translation, and a multi-input student network. To ensure the quality of the synthetic images generated by the proposed GAN we perform a detailed quantitative, and qualitative analysis with the help of specialists. Conclusion: The overall average classification accuracy, precision, and recall obtained with the proposed method for tissue classification are 0.90, 0.88, and 0.89 respectively, while the same metrics obtained in the unlabeled domain (NBI) are 0.92, 0.64, and 0.94 respectively. The quality of the generated images is reliable enough to deceive specialists. Significance: This study shows the potential of using semi-supervised GAN-based classification to improve bladder tissue classification when annotations are limited in multi-domain data.  ( 2 min )

We propose a Target Conditioned Representation Independence (TCRI) objective for domain generalization. TCRI addresses the limitations of existing domain generalization methods due to incomplete constraints. Specifically, TCRI implements regularizers motivated by conditional independence constraints that are sufficient to strictly learn complete sets of invariant mechanisms, which we show are necessary and sufficient for domain generalization. Empirically, we show that TCRI is effective on both synthetic and real-world data. TCRI is competitive with baselines in average accuracy while outperforming them in worst-domain accuracy, indicating desired cross-domain stability.  ( 2 min )

Traditional approaches to RL have focused on learning decision policies directly from episodic decisions, while slowly and implicitly learning the semantics of compositional representations needed for generalization. While some approaches have been adopted to refine representations via auxiliary self-supervised losses while simultaneously learning decision policies, learning compositional representations from hand-designed and context-independent self-supervised losses (multi-view) still adapts relatively slowly to the real world, which contains many non-IID subspaces requiring rapid distribution shift in both time and spatial attention patterns at varying levels of abstraction. In contrast, supervised language model cascades have shown the flexibility to adapt to many diverse manifolds, and hints of self-learning needed for autonomous task transfer. However, to date, transfer methods for language models like few-shot learning and fine-tuning still require human supervision and transfer learning using self-learning methods has been underexplored. We propose a self-supervised loss policy called contrastive distillation which manifests latent variables with high mutual information with both source and target tasks from weights to tokens. We show how this outperforms common methods of transfer learning and suggests a useful design axis of trading off compute for generalizability for online transfer. Contrastive distillation is improved through sampling from memory and suggests a simple algorithm for more efficiently sampling negative examples for contrastive losses than random sampling.  ( 2 min )

Current language models are considered to have sub-human capabilities at natural language tasks like question-answering or writing code. However, language models are not trained to perform well at these tasks, they are trained to accurately predict the next token given previous tokes in tokenized text. It is not clear whether language models are better or worse than humans at next token prediction. To try to answer this question, we performed two distinct experiments to directly compare humans and language models on this front: one measuring top-1 accuracy and the other measuring perplexity. In both experiments, we find humans to be consistently \emph{worse} than even relatively small language models like GPT3-Ada at next-token prediction.  ( 2 min )

Occupancy information is useful for efficient energy management in the building sector. The massive high-resolution electrical power consumption data collected by smart meters in the advanced metering infrastructure (AMI) network make it possible to infer buildings' occupancy status in a non-intrusive way. In this paper, we propose a deep leaning model called ABODE-Net which employs a novel Parallel Attention (PA) block for building occupancy detection using smart meter data. The PA block combines the temporal, variable, and channel attention modules in a parallel way to signify important features for occupancy detection. We adopt two smart meter datasets widely used for building occupancy detection in our performance evaluation. A set of state-of-the-art shallow machine learning and deep learning models are included for performance comparison. The results show that ABODE-Net significantly outperforms other models in all experimental cases, which proves its validity as a solution for non-intrusive building occupancy detection.  ( 2 min )

Automated Program Repair (APR) is defined as the process of fixing a bug/defect in the source code, by an automated tool. APR tools have recently experienced promising results by leveraging state-of-the-art Neural Language Processing (NLP) techniques. APR tools such as TFix and CodeXGLUE combine text-to-text transformers with software-specific techniques are outperforming alternatives, these days. However, in most APR studies the train and test sets are chosen from the same set of projects. In reality, however, APR models are meant to be generalizable to new and different projects. Therefore, there is a potential threat that reported APR models with high effectiveness perform poorly when the characteristics of the new project or its bugs are different than the training set's(Domain Shift). In this study, we first define and measure the domain shift problem in automated program repair. Then, we then propose a domain adaptation framework that can adapt an APR model for a given target project. We conduct an empirical study with three domain adaptation methods FullFineTuning, TuningWithLightWeightAdapterLayers, and CurriculumLearning using two state-of-the-art domain adaptation tools (TFix and CodeXGLUE) and two APR models on 611 bugs from 19 projects. The results show that our proposed framework can improve the effectiveness of TFix by 13.05% and CodeXGLUE by 23.4%. Another contribution of this study is the proposal of a data synthesis method to address the lack of labelled data in APR. We leverage transformers to create a bug generator model. We use the generated synthetic data to domain adapt TFix and CodeXGLUE on the projects with no data (Zero-shot learning), which results in an average improvement of 5.76% and 24.42% for TFix and CodeXGLUE, respectively.  ( 2 min )

Prior works on improving speech quality with visual input typically study each type of auditory distortion separately (e.g., separation, inpainting, video-to-speech) and present tailored algorithms. This paper proposes to unify these subjects and study Generalized Speech Enhancement, where the goal is not to reconstruct the exact reference clean signal, but to focus on improving certain aspects of speech. In particular, this paper concerns intelligibility, quality, and video synchronization. We cast the problem as audio-visual speech resynthesis, which is composed of two steps: pseudo audio-visual speech recognition (P-AVSR) and pseudo text-to-speech synthesis (P-TTS). P-AVSR and P-TTS are connected by discrete units derived from a self-supervised speech model. Moreover, we utilize self-supervised audio-visual speech model to initialize P-AVSR. The proposed model is coined ReVISE. ReVISE is the first high-quality model for in-the-wild video-to-speech synthesis and achieves superior performance on all LRS3 audio-visual enhancement tasks with a single model. To demonstrates its applicability in the real world, ReVISE is also evaluated on EasyCom, an audio-visual benchmark collected under challenging acoustic conditions with only 1.6 hours of training data. Similarly, ReVISE greatly suppresses noise and improves quality. Project page: https://wnhsu.github.io/ReVISE.  ( 2 min )

Machine learning methods have seen increased application to geospatial environmental problems, such as precipitation nowcasting, haze forecasting, and crop yield prediction. However, many of the machine learning methods applied to mosquito population and disease forecasting do not inherently take into account the underlying spatial structure of the given data. In our work, we apply a spatially aware graph neural network model consisting of GraphSAGE layers to forecast the presence of West Nile virus in Illinois, to aid mosquito surveillance and abatement efforts within the state. More generally, we show that graph neural networks applied to irregularly sampled geospatial data can exceed the performance of a range of baseline methods including logistic regression, XGBoost, and fully-connected neural networks.  ( 2 min )

Tensor robust principal component analysis (RPCA), which seeks to separate a low-rank tensor from its sparse corruptions, has been crucial in data science and machine learning where tensor structures are becoming more prevalent. While powerful, existing tensor RPCA algorithms can be difficult to use in practice, as their performance can be sensitive to the choice of additional hyperparameters, which are not straightforward to tune. In this paper, we describe a fast and simple self-supervised model for tensor RPCA using deep unfolding by only learning four hyperparameters. Despite its simplicity, our model expunges the need for ground truth labels while maintaining competitive or even greater performance compared to supervised deep unfolding. Furthermore, our model is capable of operating in extreme data-starved scenarios. We demonstrate these claims on a mix of synthetic data and real-world tasks, comparing performance against previously studied supervised deep unfolding methods and Bayesian optimization baselines.  ( 2 min )

Large pre-trained models, such as Bert, GPT, and Wav2Vec, have demonstrated great potential for learning representations that are transferable to a wide variety of downstream tasks . It is difficult to obtain a large quantity of supervised data due to the limited availability of resources and time. In light of this, a significant amount of research has been conducted in the area of adopting large pre-trained datasets for diverse downstream tasks via fine tuning, linear probing, or prompt tuning in low resource settings. Normalization techniques are essential for accelerating training and improving the generalization of deep neural networks and have been successfully used in a wide variety of applications. A lot of normalization techniques have been proposed but the success of normalization in low resource downstream NLP and speech tasks is limited. One of the reasons is the inability to capture expressiveness by rescaling parameters of normalization. We propose KullbackLeibler(KL) Regularized normalization (KL-Norm) which make the normalized data well behaved and helps in better generalization as it reduces over-fitting, generalises well on out of domain distributions and removes irrelevant biases and features with negligible increase in model parameters and memory overheads. Detailed experimental evaluation on multiple low resource NLP and speech tasks, demonstrates the superior performance of KL-Norm as compared to other popular normalization and regularization techniques.  ( 2 min )

The increasing capabilities of artificial intelligence (AI) systems make it ever more important that we interpret their internals to ensure that their intentions are aligned with human values. Yet there is reason to believe that misaligned artificial intelligence will have a convergent instrumental incentive to make its thoughts difficult for us to interpret. In this article, I discuss many ways that a capable AI might circumvent scalable interpretability methods and suggest a framework for thinking about these potential future risks.  ( 2 min )

Contextual bandit has been widely used for sequential decision-making based on the current contextual information and historical feedback data. In modern applications, such context format can be rich and can often be formulated as a matrix. Moreover, while existing bandit algorithms mainly focused on reward-maximization, less attention has been paid to the statistical inference. To fill in these gaps, in this work we consider a matrix contextual bandit framework where the true model parameter is a low-rank matrix, and propose a fully online procedure to simultaneously make sequential decision-making and conduct statistical inference. The low-rank structure of the model parameter and the adaptivity nature of the data collection process makes this difficult: standard low-rank estimators are not fully online and are biased, while existing inference approaches in bandit algorithms fail to account for the low-rankness and are also biased. To address these, we introduce a new online doubly-debiasing inference procedure to simultaneously handle both sources of bias. In theory, we establish the asymptotic normality of the proposed online doubly-debiased estimator and prove the validity of the constructed confidence interval. Our inference results are built upon a newly developed low-rank stochastic gradient descent estimator and its non-asymptotic convergence result, which is also of independent interest.  ( 2 min )

Quantum many-body problems are some of the most challenging problems in science and are central to demystifying some exotic quantum phenomena, e.g., high-temperature superconductors. The combination of neural networks (NN) for representing quantum states, coupled with the Variational Monte Carlo (VMC) algorithm, has been shown to be a promising method for solving such problems. However, the run-time of this approach scales quadratically with the number of simulated particles, constraining the practically usable NN to - in machine learning terms - minuscule sizes (<10M parameters). Considering the many breakthroughs brought by extreme NN in the +1B parameters scale to other domains, lifting this constraint could significantly expand the set of quantum systems we can accurately simulate on classical computers, both in size and complexity. We propose a NN architecture called Vector-Quantized Neural Quantum States (VQ-NQS) that utilizes vector-quantization techniques to leverage redundancies in the local-energy calculations of the VMC algorithm - the source of the quadratic scaling. In our preliminary experiments, we demonstrate VQ-NQS ability to reproduce the ground state of the 2D Heisenberg model across various system sizes, while reporting a significant reduction of about ${\times}10$ in the number of FLOPs in the local-energy calculation.  ( 2 min )

In this paper, we propose Adam-Hash: an adaptive and dynamic multi-resolution hashing data-structure for fast pairwise summation estimation. Given a data-set $X \subset \mathbb{R}^d$, a binary function $f:\mathbb{R}^d\times \mathbb{R}^d\to \mathbb{R}$, and a point $y \in \mathbb{R}^d$, the Pairwise Summation Estimate $\mathrm{PSE}_X(y) := \frac{1}{|X|} \sum_{x \in X} f(x,y)$. For any given data-set $X$, we need to design a data-structure such that given any query point $y \in \mathbb{R}^d$, the data-structure approximately estimates $\mathrm{PSE}_X(y)$ in time that is sub-linear in $|X|$. Prior works on this problem have focused exclusively on the case where the data-set is static, and the queries are independent. In this paper, we design a hashing-based PSE data-structure which works for the more practical \textit{dynamic} setting in which insertions, deletions, and replacements of points are allowed. Moreover, our proposed Adam-Hash is also robust to adaptive PSE queries, where an adversary can choose query $q_j \in \mathbb{R}^d$ depending on the output from previous queries $q_1, q_2, \dots, q_{j-1}$.  ( 2 min )

Music discovery services let users identify songs from short mobile recordings. These solutions are often based on Audio Fingerprinting, and rely more specifically on the extraction of spectral peaks in order to be robust to a number of distortions. Few works have been done to study the robustness of these algorithms to background noise captured in real environments. In particular, AFP systems still struggle when the signal to noise ratio is low, i.e when the background noise is strong. In this project, we tackle this problematic with Deep Learning. We test a new hybrid strategy which consists of inserting a denoising DL model in front of a peak-based AFP algorithm. We simulate noisy music recordings using a realistic data augmentation pipeline, and train a DL model to denoise them. The denoising model limits the impact of background noise on the AFP system's extracted peaks, improving its robustness to noise. We further propose a novel loss function to adapt the DL model to the considered AFP system, increasing its precision in terms of retrieved spectral peaks. To the best of our knowledge, this hybrid strategy has not been tested before.  ( 2 min )

Before the transition of AVs to urban roads and subsequently unprecedented changes in traffic conditions, evaluation of transportation policies and futuristic road design related to pedestrian crossing behavior is of vital importance. Recent studies analyzed the non-causal impact of various variables on pedestrian waiting time in the presence of AVs. However, we mainly investigate the causal effect of traffic density on pedestrian waiting time. We develop a Double/Debiased Machine Learning (DML) model in which the impact of confounders variable influencing both a policy and an outcome of interest is addressed, resulting in unbiased policy evaluation. Furthermore, we try to analyze the effect of traffic density by developing a copula-based joint model of two main components of pedestrian crossing behavior, pedestrian stress level and waiting time. The copula approach has been widely used in the literature, for addressing self-selection problems, which can be classified as a causality analysis in travel behavior modeling. The results obtained from copula approach and DML are compared based on the effect of traffic density. In DML model structure, the standard error term of density parameter is lower than copula approach and the confidence interval is considerably more reliable. In addition, despite the similar sign of effect, the copula approach estimates the effect of traffic density lower than DML, due to the spurious effect of confounders. In short, the DML model structure can flexibly adjust the impact of confounders by using machine learning algorithms and is more reliable for planning future policies.  ( 2 min )

We introduce an end-to-end computational framework that enables hyperparameter optimization with the DeepHyper library, accelerated training, and interpretable AI inference with a suite of state-of-the-art AI models, including CGCNN, PhysNet, SchNet, MPNN, MPNN-transformer, and TorchMD-Net. We use these AI models and the benchmark QM9, hMOF, and MD17 datasets to showcase the prediction of user-specified materials properties in modern computing environments, and to demonstrate translational applications for the modeling of small molecules, crystals and metal organic frameworks with a unified, stand-alone framework. We deployed and tested this framework in the ThetaGPU supercomputer at the Argonne Leadership Computing Facility, and the Delta supercomputer at the National Center for Supercomputing Applications to provide researchers with modern tools to conduct accelerated AI-driven discovery in leadership class computing environments.  ( 2 min )

Supervised learning aims to train a classifier under the assumption that training and test data are from the same distribution. To ease the above assumption, researchers have studied a more realistic setting: out-of-distribution (OOD) detection, where test data may come from classes that are unknown during training (i.e., OOD data). Due to the unavailability and diversity of OOD data, good generalization ability is crucial for effective OOD detection algorithms. To study the generalization of OOD detection, in this paper, we investigate the probably approximately correct (PAC) learning theory of OOD detection, which is proposed by researchers as an open problem. First, we find a necessary condition for the learnability of OOD detection. Then, using this condition, we prove several impossibility theorems for the learnability of OOD detection under some scenarios. Although the impossibility theorems are frustrating, we find that some conditions of these impossibility theorems may not hold in some practical scenarios. Based on this observation, we next give several necessary and sufficient conditions to characterize the learnability of OOD detection in some practical scenarios. Lastly, we also offer theoretical supports for several representative OOD detection works based on our OOD theory.  ( 2 min )

Learning the underlying Bayesian Networks (BNs), represented by directed acyclic graphs (DAGs), of the concerned events from purely-observational data is a crucial part of evidential reasoning. This task remains challenging due to the large and discrete search space. A recent flurry of developments followed NOTEARS[1] recast this combinatorial problem into a continuous optimization problem by leveraging an algebraic equality characterization of acyclicity. However, the continuous optimization methods suffer from obtaining non-spare graphs after the numerical optimization, which leads to the inflexibility to rule out the potentially cycle-inducing edges or false discovery edges with small values. To address this issue, in this paper, we develop a completely data-driven DAG structure learning method without a predefined value to post-threshold small values. We name our method NOTEARS with adaptive Lasso (NOTEARS-AL), which is achieved by applying the adaptive penalty method to ensure the sparsity of the estimated DAG. Moreover, we show that NOTEARS-AL also inherits the oracle properties under some specific conditions. Extensive experiments on both synthetic and a real-world dataset verify the efficacy of the proposed method.  ( 2 min )

We present a generalized balancing method -- stable weights via Neural Gibbs Density -- fully available for estimating causal effects for an arbitrary mixture of discrete and continuous interventions. Our weights are trainable through back-propagation and can be obtained with neural network algorithms. In addition, we also provide a method to measure the performance of our weights by estimating the mutual information for the balanced distribution. Our method is easy to implement with any present deep learning libraries, and the weights from it can be used in most state-of-art supervised algorithms.  ( 2 min )

The Fixed-X knockoff filter is a flexible framework for variable selection with false discovery rate (FDR) control in linear models with arbitrary (non-singular) design matrices and it allows for finite-sample selective inference via the LASSO estimates. In this paper, we extend the theory of the knockoff procedure to tests with composite null hypotheses, which are usually more relevant to real-world problems. The main technical challenge lies in handling composite nulls in tandem with dependent features from arbitrary designs. We develop two methods for composite inference with the knockoffs, namely, shifted ordinary least-squares (S-OLS) and feature-response product perturbation (FRPP), building on new structural properties of test statistics under composite nulls. We also propose two heuristic variants of the S-OLS method that outperform the celebrated Benjamini-Hochberg (BH) procedure for composite nulls, which serves as a heuristic baseline under dependent test statistics. Finally, we analyze the loss in FDR when the original knockoff procedure is naively applied on composite tests.  ( 2 min )

We consider a long-term average profit maximizing admission control problem in an M/M/1 queuing system with a known arrival rate but an unknown service rate. With a fixed reward collected upon service completion and a cost per unit of time enforced on customers waiting in the queue, a dispatcher decides upon arrivals whether to admit the arriving customer or not based on the full history of observations of the queue-length of the system. \cite[Econometrica]{Naor} showed that if all the parameters of the model are known, then it is optimal to use a static threshold policy - admit if the queue-length is less than a predetermined threshold and otherwise not. We propose a learning-based dispatching algorithm and characterize its regret with respect to optimal dispatch policies for the full information model of \cite{Naor}. We show that the algorithm achieves an $O(1)$ regret when all optimal thresholds with full information are non-zero, and achieves an $O(\ln^{3+\epsilon}(N))$ regret in the case that an optimal threshold with full information is $0$ (i.e., an optimal policy is to reject all arrivals), where $N$ is the number of arrivals and $\epsilon>0$.  ( 2 min )

The modeling of probability distributions, specifically generative modeling and density estimation, has become an immensely popular subject in recent years by virtue of its outstanding performance on sophisticated data such as images and texts. Nevertheless, a theoretical understanding of its success is still incomplete. One mystery is the paradox between memorization and generalization: In theory, the model is trained to be exactly the same as the empirical distribution of the finite samples, whereas in practice, the trained model can generate new samples or estimate the likelihood of unseen samples. Likewise, the overwhelming diversity of distribution learning models calls for a unified perspective on this subject. This paper provides a mathematical framework such that all the well-known models can be derived based on simple principles. To demonstrate its efficacy, we present a survey of our results on the approximation error, training error and generalization error of these models, which can all be established based on this framework. In particular, the aforementioned paradox is resolved by proving that these models enjoy implicit regularization during training, so that the generalization error at early-stopping avoids the curse of dimensionality. Furthermore, we provide some new results on landscape analysis and the mode collapse phenomenon.  ( 2 min )

Tensor robust principal component analysis (RPCA), which seeks to separate a low-rank tensor from its sparse corruptions, has been crucial in data science and machine learning where tensor structures are becoming more prevalent. While powerful, existing tensor RPCA algorithms can be difficult to use in practice, as their performance can be sensitive to the choice of additional hyperparameters, which are not straightforward to tune. In this paper, we describe a fast and simple self-supervised model for tensor RPCA using deep unfolding by only learning four hyperparameters. Despite its simplicity, our model expunges the need for ground truth labels while maintaining competitive or even greater performance compared to supervised deep unfolding. Furthermore, our model is capable of operating in extreme data-starved scenarios. We demonstrate these claims on a mix of synthetic data and real-world tasks, comparing performance against previously studied supervised deep unfolding methods and Bayesian optimization baselines.  ( 2 min )

Recovering underlying Directed Acyclic Graph (DAG) structures from observational data is highly challenging due to the combinatorial nature of the DAG-constrained optimization problem. Recently, DAG learning has been cast as a continuous optimization problem by characterizing the DAG constraint as a smooth equality one, generally based on polynomials over adjacency matrices. Existing methods place very small coefficients on high-order polynomial terms for stabilization, since they argue that large coefficients on the higher-order terms are harmful due to numeric exploding. On the contrary, we discover that large coefficients on higher-order terms are beneficial for DAG learning, when the spectral radiuses of the adjacency matrices are small, and that larger coefficients for higher-order terms can approximate the DAG constraints much better than the small counterparts. Based on this, we propose a novel DAG learning method with efficient truncated matrix power iteration to approximate geometric series based DAG constraints. Empirically, our DAG learning method outperforms the previous state-of-the-arts in various settings, often by a factor of $3$ or more in terms of structural Hamming distance.  ( 2 min )

We present an implicit likelihood approach to quantifying cosmological information over discrete catalogue data, assembled as graphs. To do so, we explore cosmological parameter constraints using mock dark matter halo catalogues. We employ Information Maximising Neural Networks (IMNNs) to quantify Fisher information extraction as a function of graph representation. We a) demonstrate the high sensitivity of modular graph structure to the underlying cosmology in the noise-free limit, b) show that graph neural network summaries automatically combine mass and clustering information through comparisons to traditional statistics, c) demonstrate that networks can still extract information when catalogues are subject to noisy survey cuts, and d) illustrate how nonlinear IMNN summaries can be used as asymptotically optimal compressed statistics for Bayesian simulation-based inference. We reduce the area of joint $\Omega_m, \sigma_8$ parameter constraints with small ($\sim$100 object) halo catalogues by a factor of 42 over the two-point correlation function, and demonstrate that the networks automatically combine mass and clustering information. This work utilises a new IMNN implementation over graph data in Jax, which can take advantage of either numerical or auto-differentiability. We also show that graph IMNNs successfully compress simulations away from the fiducial model at which the network is fitted, indicating a promising alternative to n-point statistics in catalogue simulation-based analyses.  ( 2 min )

To face the dependency on fossil fuels and limit carbon emissions, fuel cells are a very promising technology and appear to be a key candidate to tackle the increase of the energy demand and promote the energy transition. To meet future needs for both transport and stationary applications, the time to market of fuel cell stacks must be drastically reduced. Here, a new concept to shorten their development time by introducing a disruptive and highefficiency data augmentation approach based on artificial intelligence is presented. Our results allow reducing the testing time before introducing a product on the market from a thousand to a few hours. The innovative concept proposed here can support engineering and research tasks during the fuel cell development process to achieve decreased development costs alongside a reduced time to market.  ( 2 min )

A statistical ensemble of neural networks can be described in terms of a quantum field theory (NN-QFT correspondence). The infinite-width limit is mapped to a free field theory, while finite N corrections are mapped to interactions. After reviewing the correspondence, we will describe how to implement renormalization in this context and discuss preliminary numerical results for translation-invariant kernels. A major outcome is that changing the standard deviation of the neural network weight distribution corresponds to a renormalization flow in the space of networks.  ( 2 min )

State-of-the-art causal discovery methods usually assume that the observational data is complete. However, the missing data problem is pervasive in many practical scenarios such as clinical trials, economics, and biology. One straightforward way to address the missing data problem is first to impute the data using off-the-shelf imputation methods and then apply existing causal discovery methods. However, such a two-step method may suffer from suboptimality, as the imputation algorithm may introduce bias for modeling the underlying data distribution. In this paper, we develop a general method, which we call MissDAG, to perform causal discovery from data with incomplete observations. Focusing mainly on the assumptions of ignorable missingness and the identifiable additive noise models (ANMs), MissDAG maximizes the expected likelihood of the visible part of observations under the expectation-maximization (EM) framework. In the E-step, in cases where computing the posterior distributions of parameters in closed-form is not feasible, Monte Carlo EM is leveraged to approximate the likelihood. In the M-step, MissDAG leverages the density transformation to model the noise distributions with simpler and specific formulations by virtue of the ANMs and uses a likelihood-based causal discovery algorithm with directed acyclic graph constraint. We demonstrate the flexibility of MissDAG for incorporating various causal discovery algorithms and its efficacy through extensive simulations and real data experiments.  ( 2 min )

Remote sensing satellites capture the cyclic dynamics of our Planet in regular time intervals recorded in satellite time series data. End-to-end trained deep learning models use this time series data to make predictions at a large scale, for instance, to produce up-to-date crop cover maps. Most time series classification approaches focus on the accuracy of predictions. However, the earliness of the prediction is also of great importance since coming to an early decision can make a crucial difference in time-sensitive applications. In this work, we present an End-to-End Learned Early Classification of Time Series (ELECTS) model that estimates a classification score and a probability of whether sufficient data has been observed to come to an early and still accurate decision. ELECTS is modular: any deep time series classification model can adopt the ELECTS conceptual idea by adding a second prediction head that outputs a probability of stopping the classification. The ELECTS loss function then optimizes the overall model on a balanced objective of earliness and accuracy. Our experiments on four crop classification datasets from Europe and Africa show that ELECTS allows reaching state-of-the-art accuracy while reducing the quantity of data massively to be downloaded, stored, and processed. The source code is available at https://github.com/marccoru/elects.  ( 2 min )

Variational Autoencoders (VAEs) have recently been highly successful at imputing and acquiring heterogeneous missing data. However, within this specific application domain, existing VAE methods are restricted by using only one layer of latent variables and strictly Gaussian posterior approximations. To address these limitations, we present HH-VAEM, a Hierarchical VAE model for mixed-type incomplete data that uses Hamiltonian Monte Carlo with automatic hyper-parameter tuning for improved approximate inference. Our experiments show that HH-VAEM outperforms existing baselines in the tasks of missing data imputation and supervised learning with missing features. Finally, we also present a sampling-based approach for efficiently computing the information gain when missing features are to be acquired with HH-VAEM. Our experiments show that this sampling-based approach is superior to alternatives based on Gaussian approximations.  ( 2 min )

Few-shot learning (FSL) is a central problem in meta-learning, where learners must efficiently learn from few labeled examples. Within FSL, feature pre-training has recently become an increasingly popular strategy to significantly improve generalization performance. However, the contribution of pre-training is often overlooked and understudied, with limited theoretical understanding of its impact on meta-learning performance. Further, pre-training requires a consistent set of global labels shared across training tasks, which may be unavailable in practice. In this work, we address the above issues by first showing the connection between pre-training and meta-learning. We discuss why pre-training yields more robust meta-representation and connect the theoretical analysis to existing works and empirical results. Secondly, we introduce Meta Label Learning (MeLa), a novel meta-learning algorithm that learns task relations by inferring global labels across tasks. This allows us to exploit pre-training for FSL even when global labels are unavailable or ill-defined. Lastly, we introduce an augmented pre-training procedure that further improves the learned meta-representation. Empirically, MeLa outperforms existing methods across a diverse range of benchmarks, in particular under a more challenging setting where the number of training tasks is limited and labels are task-specific. We also provide extensive ablation study to highlight its key properties.  ( 2 min )

Co-clustering is a class of unsupervised data analysis techniques that extract the existing underlying dependency structure between the instances and variables of a data table as homogeneous blocks. Most of those techniques are limited to variables of the same type. In this paper, we propose a mixed data co-clustering method based on a two-step methodology. In the first step, all the variables are binarized according to a number of bins chosen by the analyst, by equal frequency discretization in the numerical case, or keeping the most frequent values in the categorical case. The second step applies a co-clustering to the instances and the binary variables, leading to groups of instances and groups of variable parts. We apply this methodology on several data sets and compare with the results of a Multiple Correspondence Analysis applied to the same data.  ( 2 min )

Machine learning (ML) models are nowadays used in complex applications in various domains, such as medicine, bioinformatics, and other sciences. Due to their black box nature, however, it may sometimes be hard to understand and trust the results they provide. This has increased the demand for reliable visualization tools related to enhancing trust in ML models, which has become a prominent topic of research in the visualization community over the past decades. To provide an overview and present the frontiers of current research on the topic, we present a State-of-the-Art Report (STAR) on enhancing trust in ML models with the use of interactive visualization. We define and describe the background of the topic, introduce a categorization for visualization techniques that aim to accomplish this goal, and discuss insights and opportunities for future research directions. Among our contributions is a categorization of trust against different facets of interactive ML, expanded and improved from previous research. Our results are investigated from different analytical perspectives: (a) providing a statistical overview, (b) summarizing key findings, (c) performing topic analyses, and (d) exploring the data sets used in the individual papers, all with the support of an interactive web-based survey browser. We intend this survey to be beneficial for visualization researchers whose interests involve making ML models more trustworthy, as well as researchers and practitioners from other disciplines in their search for effective visualization techniques suitable for solving their tasks with confidence and conveying meaning to their data.  ( 2 min )

This paper is devoted to the numerical resolution of McKean-Vlasov control problems via the class of mean-field neural networks introduced in our companion paper [25] in order to learn the solution on the Wasserstein space. We propose several algorithms either based on dynamic programming with control learning by policy or value iteration, or backward SDE from stochastic maximum principle with global or local loss functions. Extensive numerical results on different examples are presented to illustrate the accuracy of each of our eight algorithms. We discuss and compare the pros and cons of all the tested methods.  ( 2 min )

Partial differential equations (PDEs) are widely used for description of physical and engineering phenomena. Some key parameters involved in PDEs, which represents certain physical properties with important scientific interpretations, are difficult or even impossible to be measured directly. Estimation of these parameters from noisy and sparse experimental data of related physical quantities is an important task. Many methods for PDE parameter inference involve a large number of evaluations of numerical solution of PDE through algorithms such as finite element method, which can be time-consuming especially for nonlinear PDEs. In this paper, we propose a novel method for estimating unknown parameters in PDEs, called PDE-Informed Gaussian Process Inference (PIGPI). Through modeling the PDE solution as a Gaussian process (GP), we derive the manifold constraints induced by the (linear) PDE structure such that under the constraints, the GP satisfies the PDE. For nonlinear PDEs, we propose an augmentation method that transfers the nonlinear PDE into an equivalent PDE system linear in all derivatives that our PIGPI can handle. PIGPI can be applied to multi-dimensional PDE systems and PDE systems with unobserved components. The method completely bypasses the numerical solver for PDE, thus achieving drastic savings in computation time, especially for nonlinear PDEs. Moreover, the PIGPI method can give the uncertainty quantification for both the unknown parameters and the PDE solution. The proposed method is demonstrated by several application examples from different areas.  ( 2 min )

In recent years the applications of machine learning models have increased rapidly, due to the large amount of available data and technological progress.While some domains like web analysis can benefit from this with only minor restrictions, other fields like in medicine with patient data are strongerregulated. In particular \emph{data privacy} plays an important role as recently highlighted by the trustworthy AI initiative of the EU or general privacy regulations in legislation. Another major challenge is, that the required training \emph{data is} often \emph{distributed} in terms of features or samples and unavailable for classicalbatch learning approaches. In 2016 Google came up with a framework, called \emph{Federated Learning} to solve both of these problems. We provide a brief overview on existing Methods and Applications in the field of vertical and horizontal \emph{Federated Learning}, as well as \emph{Fderated Transfer Learning}.  ( 2 min )

Co-clustering is a data mining technique used to extract the underlying block structure between the rows and columns of a data matrix. Many approaches have been studied and have shown their capacity to extract such structures in continuous, binary or contingency tables. However, very little work has been done to perform co-clustering on mixed type data. In this article, we extend the latent block models based co-clustering to the case of mixed data (continuous and binary variables). We then evaluate the effectiveness of the proposed approach on simulated data and we discuss its advantages and potential limits.  ( 2 min )

Contextual bandit has been widely used for sequential decision-making based on the current contextual information and historical feedback data. In modern applications, such context format can be rich and can often be formulated as a matrix. Moreover, while existing bandit algorithms mainly focused on reward-maximization, less attention has been paid to the statistical inference. To fill in these gaps, in this work we consider a matrix contextual bandit framework where the true model parameter is a low-rank matrix, and propose a fully online procedure to simultaneously make sequential decision-making and conduct statistical inference. The low-rank structure of the model parameter and the adaptivity nature of the data collection process makes this difficult: standard low-rank estimators are not fully online and are biased, while existing inference approaches in bandit algorithms fail to account for the low-rankness and are also biased. To address these, we introduce a new online doubly-debiasing inference procedure to simultaneously handle both sources of bias. In theory, we establish the asymptotic normality of the proposed online doubly-debiased estimator and prove the validity of the constructed confidence interval. Our inference results are built upon a newly developed low-rank stochastic gradient descent estimator and its non-asymptotic convergence result, which is also of independent interest.  ( 2 min )

Hey r/artificial! I'm new here, and also fairly new to video content creation, so please be kind! I don't have many close friends that are very interested in AI so I figured I might turn to Reddit for some constructive feedback. The intent of this series will be to cover AI news once every few weeks, and to have it be centered around content that appeals to a diverse audience (from fellow tech nerds, to your parents alike). I know the text scrolling is not great so I will work on figuring out something better for the next video, but any other suggestions or advice on how I can improve this are greatly appreciated! AI News - Episode 1 - Dec. 2022 - https://www.youtube.com/watch?v=QtjY_dINLyU submitted by /u/Kitten-Smuggler [link] [comments]  ( 50 min )

I asked chatgpt which animal was the biggest; a whale shark or an elephant (inspired by a LinkedIn-post). Chatgpt claims the elephant is bigger even though it’s wrong. I therefore started wondering how reliable a (C)NN (or other subsymbolic method) can become as a AI. I think many people regard chatgpt as a kind of AGI and not as amodel who can put words nicely together (which in itself is super impressive). Do we expect reasoning and logic to arrive with more parameters and model layers? Or should we always except these models to make mistakes? Doesn’t mathematical logic require hard coded rules and not (gradient descent) optimized models? What I’m asking is: are the NN approach ever gonna achieve reliable logic? (I’m really not a gpt hater! I got huge respect for the work of openai!!) submitted by /u/Keepitsimpleistaken [link] [comments]  ( 59 min )

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Hi, guys. Could you please suggest to me any forum or a chat where I can find people who are truly beginners in AI with which I could learn AI and also try to create some pet projects as a team? submitted by /u/flexjump [link] [comments]  ( 49 min )

I started working on this yesterday, so still very much a work in progress. The idea is that you can use AI art generation and save those images to panels to create either story boards or web comics. I plan on adding toggles for style and uniformity between the panels. Let me know what you think please! https://storaiboard.com/ submitted by /u/Iz4k4y4 [link] [comments]  ( 50 min )

Seeing artificial intelligence developing in an unstoppable way, I feel like it can make everything possible. Let me know your views regarding this question. submitted by /u/iTsForza [link] [comments]  ( 48 min )

I will collect some important generative model papers and make some notes and keep this post updated. Just for the self-summarization and welcome further discussions on this topic together. :D ​ Generative Models: High-Resolution Image Synthesis with Latent Diffusion Models: motivation and overview. [cvpr2022] {cite:300} Robin Rombach, Björn Ommer Traditional models are very space-consuming because they are applied to pixels. This paper applies diffusion models to the latent space, reducing computational requirements while maintaining the quality of the generated. Palette: Image-to-Image Diffusion Models [arxiv] {cite:100} Chitwan Saharia, Mohammad Norouzi This is an image-to-image paper based on diffusion, with a simple idea of adding a condition input in the denoise model. f_{\the…  ( 76 min )

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Well here's the story https://docs.google.com/document/d/1u5Am2j5koDBzss8kf5iJySG2dJ0Z1rhwa2hdTqSVeQ8/edit?usp=drivesdk Just remember this story was created by ten different AI each sentence created by a different one. I did give the first AI that created the first sentence a little bit of backstory about both characters. This was an experiment to see if different AI could work together to create something. submitted by /u/Competitive_Case1076 [link] [comments]  ( 51 min )

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Did anyone take this boot camp? How was it? thanks submitted by /u/cambridgecoder415 [link] [comments]  ( 66 min )

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Creating this thread for AI Residency applicants at Meta 2023. Any new information or update on application/interview are welcome. Can also have general discussion about applicant backgrounds, backups and future plans. submitted by /u/Around-star [link] [comments]  ( 65 min )

https://mlem-nice-or-naughty.fly.dev Please enjoy! :) And, here is the blog post about DDoSing Santa's website and training a Christmas decision tree ^ https://medium.com/@mike0sv/i-trained-a-model-to-tell-if-you-were-naughty-this-year-11a36ca6d472 Have a good New Year's mood! submitted by /u/1aguschin [link] [comments]  ( 65 min )

Github Link: https://github.com/kpthedev/stable-karlo I made stable-karlo, an app that combines Kakaobrain's Karlo image generation model with Stable-Diffusion 2.1 in a nice webUI. Recently, Kakaobrain released Karlo, their own image generating diffusion model which uses OpenAI's unCLIP architecture. The model is great at understanding text and relationships, but it only outputs 256x256 pixel images. I had the idea to combine Karlo with the new Stable-Diffusion v2 upscaler to get large images and the results are very promising. Please check out the Github and share your thoughts! submitted by /u/kpthedev [link] [comments]  ( 73 min )

A guy on Twitter shared a ChatGPT that is aware of all the podcasts from Andrew Huberman, which is great (https://huberman.rile.yt/?query=) Has anyone open sourced something like ChatGPT that it is easy to fine tune with external knowledge, potentially tested on scientific papers? It would be great for brainstorming, writing research proposal and exploring the literature in a different way. Maybe even integrating it with Zotero. As of now I talked about finetuning the model, but let’s say I take the easier path of few shot learning instead. Is there a way to save the state of ChatGPT? In other words, if I open a new chat and feed it all the papers by copy and paste for example, is there a way I can use it next week? Sometimes I have found the session to expire, but recently it seems past chats are saved. Will this last indefinitely you believe? TL;DR: best way to adapt ChatGPT to specific knowledge? submitted by /u/justrandomtourist [link] [comments]  ( 66 min )

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Hi! I'm relatively new to machine learning and came up w a project of my own. I'm hoping to create a database to suit the needs of my project and was thinking whether there are any APIs available to assist me. The data that I am looking for are molecular data, mainly their optical properties and ADME-T. Please let me know if this is the wrong place to ask, thanks! submitted by /u/NotPaulDirac [link] [comments]  ( 66 min )

It was one thing with DALLE-2, but at least it couldn’t talk back to them. I mean I have been in board meetings with powerful people in leadership positions that have nothing to do with tech have absolutely horrendous ideas about what ChatGPT is- I am not lying, I have genuinely heard them say they believe it’s basically conscious and using excerpt screenshots of it saying it hates humans as a basis to make business decisions about the future of AI in their company. Like….WHAT? Have other people heard absurd things like this too? I think it’s just hard to see the professional reality of machine learning, becoming extremely debased from the general public idea of machine learning. I’m sure as we all get even better at our jobs it’s only going to get much much worse. I wouldn’t be surprised if soon we are the new magical witches of the world. i’ll see you guys on the pyres in 20 years.( ok really I’m just joking on that last part) What do you all think? submitted by /u/gettheflyoffmycock [link] [comments]  ( 91 min )

I have an environment that produces two reward functions r1(s, a, s') and r2(s, a, s') and the task is continuing, i.e. there is no episode end. I want to find the policy that maximizes the ratio `R1 / R2` where R1, R2 are the total discounted reward for r1 and r2. In particular, the environment is such that there is a trade-off between r1 and r2, i.e. some action might increase r1 at the expense of r2. To the best of my knowledge, there is no way of breaking down R1 / R2 into a sum of single-step rewards. And if I create a linear combination alpha * r1 - beta * r2, it becomes very difficult for me to balance alpha and beta to achieve maximal R1 / R2. Do you know any work that deals with a similar problem? Would an on-policy algorithm like PPO with two value estimators V1 and V2, and the policy being updated with respect to V1/V2 work? I am going to try soon, but I'm unsure about its theoretical grounds. submitted by /u/fedetask [link] [comments]  ( 57 min )

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submitted by /u/mrx-ai [link] [comments]  ( 59 min )

What resources do you recommend for someone just getting started in RL? I am a pretty familiar with supervised learning and different algorithms/tradeoffs but RL is a newer paradigm for me. I’m finishing the RL 2021 lecture series from DeepMind and fascinated in learning more, but just trying to find a good place to start. Thanks! submitted by /u/code4funle [link] [comments]  ( 59 min )

Recently I've been really inspired by the superhuman self-driving AI that Polyphony Digital has made a few years ago for Gran Turismo, and ideally I would have loved to create a similar AI that performs as well on a different racing game, but looking into the paper it's clear it might be a little out of reach for me (4 PS4s x 20 cars simulated each + 4 1080s for training x several days of wallclock time = oof my poor i3 6100, not mentioning the features used that are going to be difficult having without access to the game's code). Looking into more general algorithms like MuZero and EfficientZero doesn't help much either as even a simple Atari game needs billions of frames and hundreds of GPUs to properly converge. So basically I'm looking for ideas that I could realistically implement, though it doesn't have to run locally only, maybe it could work like AlphaZero where I'd gather random data locally, train a network with the new data on Kaggle, gather new data using the new network and so on. Or maybe something that could run entirely on Kaggle, though that would mean no desktop environment which could be limiting. Other than self-driving AIs I've also been impressed by applications in the engineering sector, like that AI from a while back that could design chips or 3d topology optimization with "generative design". So I'm open to anything really. Thanks! submitted by /u/real_beary [link] [comments]  ( 59 min )

Customer service interactions often contain personally identifiable information (PII) such as names, phone numbers, and dates of birth. As organizations incorporate machine learning (ML) and analytics into their applications, using this data can provide insights on how to create more seamless customer experiences. However, the presence of PII information often restricts the use of this […]  ( 7 min )

submitted by /u/Prior_Appearance_44 [link] [comments]  ( 45 min )

For many people, synthetic data is synonymous with simulations, mock or fake data. The reality is very different. The purpose of this article is to explain what it is about. I discuss potential applications, benefits, limitations, and some little-known facts that synthetic data vendors don’t want you to know, mostly because they are unaware of… Read More »Little-known Secrets About Synthetic Data The post Little-known Secrets About Synthetic Data appeared first on Data Science Central.  ( 21 min )

We present an effective graph neural network (GNN)-based knowledge graph embedding model, which we name WGE, to capture entity- and relation-focused graph structures. Given a knowledge graph, WGE builds a single undirected entity-focused graph that views entities as nodes. WGE also constructs another single undirected graph from relation-focused constraints, which views entities and relations as nodes. WGE then proposes a GNN-based architecture to better learn vector representations of entities and relations from these two single entity- and relation-focused graphs. WGE feeds the learned entity and relation representations into a weighted score function to return the triple scores for knowledge graph completion. Experimental results show that WGE outperforms competitive baselines, obtaining state-of-the-art performances on seven benchmark datasets for knowledge graph completion.  ( 2 min )

Generated texts from large pretrained language models have been shown to exhibit a variety of harmful, human-like biases about various demographics. These findings prompted large efforts aiming to understand and measure such effects, with the goal of providing benchmarks that can guide the development of techniques mitigating these stereotypical associations. However, as recent research has pointed out, the current benchmarks lack a robust experimental setup, consequently hindering the inference of meaningful conclusions from their evaluation metrics. In this paper, we extend these arguments and demonstrate that existing techniques and benchmarks aiming to measure stereotypes tend to be inaccurate and consist of a high degree of experimental noise that severely limits the knowledge we can gain from benchmarking language models based on them. Accordingly, we propose a new framework for robustly measuring and quantifying biases exhibited by generative language models. Finally, we use this framework to investigate GPT-3's occupational gender bias and propose prompting techniques for mitigating these biases without the need for fine-tuning.  ( 2 min )

A central challenge of building more powerful Graph Neural Networks (GNNs) is the oversmoothing phenomenon, where increasing the network depth leads to homogeneous node representations and thus worse classification performance. While previous works have only demonstrated that oversmoothing is inevitable when the number of graph convolutions tends to infinity, in this paper, we precisely characterize the mechanism behind the phenomenon via a non-asymptotic analysis. Specifically, we distinguish between two different effects when applying graph convolutions -- an undesirable mixing effect that homogenizes node representations in different classes, and a desirable denoising effect that homogenizes node representations in the same class. By quantifying these two effects on random graphs sampled from the Contextual Stochastic Block Model (CSBM), we show that oversmoothing happens once the mixing effect starts to dominate the denoising effect, and the number of layers required for this transition is $O(\log N/\log (\log N))$ for sufficiently dense graphs with $N$ nodes. We also extend our analysis to study the effects of Personalized PageRank (PPR) on oversmoothing. Our results suggest that while PPR mitigates oversmoothing at deeper layers, PPR-based architectures still achieve their best performance at a shallow depth and are outperformed by the graph convolution approach on certain graphs. Finally, we support our theoretical results with numerical experiments, which further suggest that the oversmoothing phenomenon observed in practice may be exacerbated by the difficulty of optimizing deep GNN models.  ( 2 min )

Climate change has increased the intensity, frequency, and duration of extreme weather events and natural disasters across the world. While the increased data on natural disasters improves the scope of machine learning (ML) in this field, progress is relatively slow. One bottleneck is the lack of benchmark datasets that would allow ML researchers to quantify their progress against a standard metric. The objective of this short paper is to explore the state of benchmark datasets for ML tasks related to natural disasters, categorizing them according to the disaster management cycle. We compile a list of existing benchmark datasets introduced in the past five years. We propose a web platform - NADBenchmarks - where researchers can search for benchmark datasets for natural disasters, and we develop a preliminary version of such a platform using our compiled list. This paper is intended to aid researchers in finding benchmark datasets to train their ML models on, and provide general directions for topics where they can contribute new benchmark datasets.  ( 2 min )

Through in-context learning (ICL), large-scale language models are effective few-shot learners without additional model fine-tuning. However, the ICL performance does not scale well with the number of available training samples as it is limited by the inherent input length constraint of the underlying language model. Meanwhile, many studies have revealed that language models are also powerful feature extractors, allowing them to be utilized in a black-box manner and enabling the linear probing paradigm, where lightweight discriminators are trained on top of the pre-extracted input representations. This paper proposes prompt-augmented linear probing (PALP), a hybrid of linear probing and ICL, which leverages the best of both worlds. PALP inherits the scalability of linear probing and the capability of enforcing language models to derive more meaningful representations via tailoring input into a more conceivable form. Throughout in-depth investigations on various datasets, we verified that PALP significantly enhances the input representations closing the gap between ICL in the data-hungry scenario and fine-tuning in the data-abundant scenario with little training overhead, potentially making PALP a strong alternative in a black-box scenario.  ( 2 min )

Biometric data privacy is becoming a major concern for many organizations in the age of big data, particularly in the ICT sector, because it may be easily exploited in apps. Most apps utilize biometrics by accessing common application programming interfaces (APIs); hence, we aim to categorize their usage. The categorization based on behavior may be closely correlated with the sensitive processing of a user's biometric data, hence highlighting crucial biometric data privacy assessment concerns. We propose PABAU, Privacy Analysis of Biometric API Usage. PABAU learns semantic features of methods in biometric APIs and uses them to detect and categorize the usage of biometric API implementation in the software according to their privacy-related behaviors. This technique bridges the communication and background knowledge gap between technical and non-technical individuals in organizations by providing an automated method for both parties to acquire a rapid understanding of the essential behaviors of biometric API in apps, as well as future support to data protection officers (DPO) with legal documentation, such as conducting a Data Protection Impact Assessment (DPIA).

This paper presents an open and comprehensive framework to systematically evaluate state-of-the-art contributions to self-supervised monocular depth estimation. This includes pretraining, backbone, architectural design choices and loss functions. Many papers in this field claim novelty in either architecture design or loss formulation. However, simply updating the backbone of historical systems results in relative improvements of 25%, allowing them to outperform the majority of existing systems. A systematic evaluation of papers in this field was not straightforward. The need to compare like-with-like in previous papers means that longstanding errors in the evaluation protocol are ubiquitous in the field. It is likely that many papers were not only optimized for particular datasets, but also for errors in the data and evaluation criteria. To aid future research in this area, we release a modular codebase (https://github.com/jspenmar/monodepth_benchmark), allowing for easy evaluation of alternate design decisions against corrected data and evaluation criteria. We re-implement, validate and re-evaluate 16 state-of-the-art contributions and introduce a new dataset (SYNS-Patches) containing dense outdoor depth maps in a variety of both natural and urban scenes. This allows for the computation of informative metrics in complex regions such as depth boundaries.

Recent work shows that the expressive power of Graph Neural Networks (GNNs) in distinguishing non-isomorphic graphs is exactly the same as that of the Weisfeiler-Lehman (WL) graph test. In particular, they show that the WL test can be simulated by GNNs. However, those simulations involve neural networks for the 'combine' function of size polynomial or even exponential in the number of graph nodes $n$, as well as feature vectors of length linear in $n$. We present an improved simulation of the WL test on GNNs with \emph{exponentially} lower complexity. In particular, the neural network implementing the combine function in each node has only a polylogarithmic number of parameters in $n$, and the feature vectors exchanged by the nodes of GNN consists of only $O(\log n)$ bits. We also give logarithmic lower bounds for the feature vector length and the size of the neural networks, showing the (near)-optimality of our construction.

Online Social Networks have embarked on the importance of connection strength measures which has a broad array of applications such as, analyzing diffusion behaviors, community detection, link predictions, recommender systems. Though there are some existing connection strength measures, the density that a connection shares with it's neighbors and the directionality aspect has not received much attention. In this paper, we have proposed an asymmetric edge similarity measure namely, Neighborhood Density-based Edge Similarity (NDES) which provides a fundamental support to derive the strength of connection. The time complexity of NDES is $O(nk^2)$. An application of NDES for community detection in social network is shown. We have considered a similarity based community detection technique and substituted its similarity measure with NDES. The performance of NDES is evaluated on several small real-world datasets in terms of the effectiveness in detecting communities and compared with three widely used similarity measures. Empirical results show NDES enables detecting comparatively better communities both in terms of accuracy and quality.

Biological vision systems are unparalleled in their ability to learn visual representations without supervision. In machine learning, self-supervised learning (SSL) has led to major advances in forming object representations in an unsupervised fashion. Such systems learn representations invariant to augmentation operations over images, like cropping or flipping. In contrast, biological vision systems exploit the temporal structure of the visual experience during natural interactions with objects. This gives access to "augmentations" not commonly used in SSL, like watching the same object from multiple viewpoints or against different backgrounds. Here, we systematically investigate and compare the potential benefits of such time-based augmentations during natural interactions for learning object categories. Our results show that time-based augmentations achieve large performance gains over state-of-the-art image augmentations. Specifically, our analyses reveal that: 1) 3-D object manipulations drastically improve the learning of object categories; 2) viewing objects against changing backgrounds is important for learning to discard background-related information from the latent representation. Overall, we conclude that time-based augmentations during natural interactions with objects can substantially improve self-supervised learning, narrowing the gap between artificial and biological vision systems.

Candidate axiom scoring is the task of assessing the acceptability of a candidate axiom against the evidence provided by known facts or data. The ability to score candidate axioms reliably is required for automated schema or ontology induction, but it can also be valuable for ontology and/or knowledge graph validation. Accurate axiom scoring heuristics are often computationally expensive, which is an issue if you wish to use them in iterative search techniques like level-wise generate-and-test or evolutionary algorithms, which require scoring a large number of candidate axioms. We address the problem of developing a predictive model as a substitute for reasoning that predicts the possibility score of candidate class axioms and is quick enough to be employed in such situations. We use a semantic similarity measure taken from an ontology's subsumption structure for this purpose. We show that the approach provided in this work can accurately learn the possibility scores of candidate OWL class axioms and that it can do so for a variety of OWL class axioms.

To date, most directed acyclic graphs (DAGs) structure learning approaches require data to be stored in a central server. However, due to the consideration of privacy protection, data owners gradually refuse to share their personalized raw data to avoid private information leakage, making this task more troublesome by cutting off the first step. Thus, a puzzle arises: \textit{how do we discover the underlying DAG structure from decentralized data?} In this paper, focusing on the additive noise models (ANMs) assumption of data generation, we take the first step in developing a gradient-based learning framework named FedDAG, which can learn the DAG structure without directly touching the local data and also can naturally handle the data heterogeneity. Our method benefits from a two-level structure of each local model. The first level structure learns the edges and directions of the graph and communicates with the server to get the model information from other clients during the learning procedure, while the second level structure approximates the mechanisms among variables and personally updates on its own data to accommodate the data heterogeneity. Moreover, FedDAG formulates the overall learning task as a continuous optimization problem by taking advantage of an equality acyclicity constraint, which can be solved by gradient descent methods to boost the searching efficiency. Extensive experiments on both synthetic and real-world datasets verify the efficacy of the proposed method.

In this paper, we studied the federated bilevel optimization problem, which has widespread applications in machine learning. In particular, we developed two momentum-based algorithms for optimizing this kind of problem and established the convergence rate of our two algorithms, providing the sample and communication complexities. Importantly, to the best of our knowledge, our convergence rate is the first one achieving the linear speedup with respect to the number of devices for federated bilevel optimization algorithms. At last, our extensive experimental results confirm the effectiveness of our two algorithms.

Very large deep learning models trained using gradient descent are remarkably resistant to memorization given their huge capacity, but are at the same time capable of fitting large datasets of pure noise. Here methods are introduced by which models may be trained to memorize datasets that normally are generalized. We find that memorization is difficult relative to generalization, but that adding noise makes memorization easier. Increasing the dataset size exaggerates the characteristics of that dataset: model access to more training samples makes overfitting easier for random data, but somewhat harder for natural images. The bias of deep learning towards generalization is explored theoretically, and we show that generalization results from a model's parameters being attracted to points of maximal stability with respect to that model's inputs during gradient descent.

Researchers have observed that the frequencies of leading digits in many man-made and naturally occurring datasets follow a logarithmic curve, with digits that start with the number 1 accounting for $\sim 30\%$ of all numbers in the dataset and digits that start with the number 9 accounting for $\sim 5\%$ of all numbers in the dataset. This phenomenon, known as Benford's Law, is highly repeatable and appears in lists of numbers from electricity bills, stock prices, tax returns, house prices, death rates, lengths of rivers, and naturally occurring images. In this paper we demonstrate that human speech spectra also follow Benford's Law on average. That is, when averaged over many speakers, the frequencies of leading digits in speech magnitude spectra follow this distribution, although with some variability at the individual sample level. We use this observation to motivate a new set of features that can be efficiently extracted from speech and demonstrate that these features can be used to classify between human speech and synthetic speech.

A concise and measurable set of FAIR (Findable, Accessible, Interoperable and Reusable) principles for scientific data is transforming the state-of-practice for data management and stewardship, supporting and enabling discovery and innovation. Learning from this initiative, and acknowledging the impact of artificial intelligence (AI) in the practice of science and engineering, we introduce a set of practical, concise, and measurable FAIR principles for AI models. We showcase how to create and share FAIR data and AI models within a unified computational framework combining the following elements: the Advanced Photon Source at Argonne National Laboratory, the Materials Data Facility, the Data and Learning Hub for Science, and funcX, and the Argonne Leadership Computing Facility (ALCF), in particular the ThetaGPU supercomputer and the SambaNova DataScale system at the ALCF AI Testbed. We describe how this domain-agnostic computational framework may be harnessed to enable autonomous AI-driven discovery.

Global correlations are widely seen in human anatomical structures due to similarity across tissues and bones. These correlations are reflected in magnetic resonance imaging (MRI) scans as a result of close-range proton density and T1/T2 parameters. Furthermore, to achieve accelerated MRI, k-space data are undersampled which causes global aliasing artifacts. Convolutional neural network (CNN) models are widely utilized for accelerated MRI reconstruction, but those models are limited in capturing global correlations due to the intrinsic locality of the convolution operation. The self-attention-based transformer models are capable of capturing global correlations among image features, however, the current contributions of transformer models for MRI reconstruction are minute. The existing contributions mostly provide CNN-transformer hybrid solutions and rarely leverage the physics of MRI. In this paper, we propose a physics-based stand-alone (convolution free) transformer model titled, the Multi-head Cascaded Swin Transformers (McSTRA) for accelerated MRI reconstruction. McSTRA combines several interconnected MRI physics-related concepts with the transformer networks: it exploits global MR features via the shifted window self-attention mechanism; it extracts MR features belonging to different spectral components separately using a multi-head setup; it iterates between intermediate de-aliasing and k-space correction via a cascaded network with data consistency in k-space and intermediate loss computations; furthermore, we propose a novel positional embedding generation mechanism to guide self-attention utilizing the point spread function corresponding to the undersampling mask. Our model significantly outperforms state-of-the-art MRI reconstruction methods both visually and quantitatively while depicting improved resolution and removal of aliasing artifacts.

When comparing approximate Gaussian process (GP) models, it can be helpful to be able to generate data from any GP. If we are interested in how approximate methods perform at scale, we may wish to generate very large synthetic datasets to evaluate them. Na\"{i}vely doing so would cost \(\mathcal{O}(n^3)\) flops and \(\mathcal{O}(n^2)\) memory to generate a size \(n\) sample. We demonstrate how to scale such data generation to large \(n\) whilst still providing guarantees that, with high probability, the sample is indistinguishable from a sample from the desired GP.

Although large language models (LLMs) often produce impressive outputs, it remains unclear how they perform in real-world scenarios requiring strong reasoning skills and expert domain knowledge. We set out to investigate whether GPT-3.5 (Codex and InstructGPT) can be applied to answer and reason about difficult real-world-based questions. We utilize two multiple-choice medical exam questions (USMLE and MedMCQA) and a medical reading comprehension dataset (PubMedQA). We investigate multiple prompting scenarios: Chain-of-Thought (CoT, think step-by-step), zero- and few-shot (prepending the question with question-answer exemplars) and retrieval augmentation (injecting Wikipedia passages into the prompt). For a subset of the USMLE questions, a medical expert reviewed and annotated the model's CoT. We found that InstructGPT can often read, reason and recall expert knowledge. Failure are primarily due to lack of knowledge and reasoning errors and trivial guessing heuristics are observed, e.g.\ too often predicting labels A and D on USMLE. Sampling and combining many completions overcome some of these limitations. Using 100 samples, Codex 5-shot CoT not only gives close to well-calibrated predictive probability but also achieves human-level performances on the three datasets. USMLE: 60.2%, MedMCQA: 57.5% and PubMedQA: 78.2%.

Medical image segmentation is an actively studied task in medical imaging, where the precision of the annotations is of utter importance towards accurate diagnosis and treatment. In recent years, the task has been approached with various deep learning systems, among the most popular models being U-Net. In this work, we propose a novel strategy to generate ensembles of different architectures for medical image segmentation, by leveraging the diversity (decorrelation) of the models forming the ensemble. More specifically, we utilize the Dice score among model pairs to estimate the correlation between the outputs of the two models forming each pair. To promote diversity, we select models with low Dice scores among each other. We carry out gastro-intestinal tract image segmentation experiments to compare our diversity-promoting ensemble (DiPE) with another strategy to create ensembles based on selecting the top scoring U-Net models. Our empirical results show that DiPE surpasses both individual models as well as the ensemble creation strategy based on selecting the top scoring models.

Automatic programming has been actively studied for a long time by various approaches including genetic programming. In recent years, automatic programming using neural networks such as GPT-3 has been actively studied and is attracting a lot of attention. However, these methods are illogical inference based on experience by enormous learning, and their thinking process is unclear. Even using the method by logical inference with a clear thinking process, the system that automatically generates any programs has not yet been realized. Especially, the inductive inference generalized by logical inference from one example is an important issue that the artificial intelligence can acquire knowledge by itself. In this study, we propose NP4G: Network Programming for Generalization, which can automatically generate programs by inductive inference. Because the proposed method can realize "sequence", "selection", and "iteration" in programming and can satisfy the conditions of the structured program theorem, it is expected that NP4G is a method automatically acquire any programs by inductive inference. As an example, we automatically construct a bitwise NOT operation program from several training data by generalization using NP4G. Although NP4G only randomly selects and connects nodes, by adjusting the number of nodes and the number of phase of "Phased Learning", we show the bitwise NOT operation programs are acquired in a comparatively short time and at a rate of about 7 in 10 running. The source code of NP4G is available on GitHub as a public repository.

The arrival of handwriting recognition technologies offers new possibilities to research in heritage studies. However, it is now necessary to reflect on the experiences and the practices developed by research teams. Our use of the Transkribus platform since 2018 has led us to search for the most significant ways to improve the performance of our handwritten recognition models (HTR) which are made to transcribe French handwriting dating from the 17th century. This article therefore reports on the impacts of creating transcribing protocols, using the lexical elements at full scale and determining the best way to use base model in order to help to increase the performance of HTR models. Combining all of these elements can indeed increase the performance of a single model by more than 20% (reaching a Character Error Rate below 5%). It also discusses some challenges regarding the collaborative nature of HTR platforms such as Transkribus and the way researchers can share their data generated in the process of creating or training handwritten text recognition models.

We consider the problem of embedding character-entity relationships from the reduced semantic space of narratives, proposing and evaluating the assumption that these relationships hold under a reflection operation. We analyze this assumption and compare the approach to a baseline state-of-the-art model with a unique evaluation that simulates efficacy on a downstream clustering task with human-created labels. Although our model creates clusters that achieve Silhouette scores of -.084, outperforming the baseline -.227, our analysis reveals that the models approach the task much differently and perform well on very different examples. We conclude that our assumption might be useful for specific types of data and should be evaluated on a wider range of tasks.

Spectral geometric methods have brought revolutionary changes to the field of geometry processing. Of particular interest is the study of the Laplacian spectrum as a compact, isometry and permutation-invariant representation of a shape. Some recent works show how the intrinsic geometry of a full shape can be recovered from its spectrum, but there are approaches that consider the more challenging problem of recovering the geometry from the spectral information of partial shapes. In this paper, we propose a possible way to fill this gap. We introduce a learning-based method to estimate the Laplacian spectrum of the union of partial non-rigid 3D shapes, without actually computing the 3D geometry of the union or any correspondence between those partial shapes. We do so by operating purely in the spectral domain and by defining the union operation between short sequences of eigenvalues. We show that the approximated union spectrum can be used as-is to reconstruct the complete geometry [MRC*19], perform region localization on a template [RTO*19] and retrieve shapes from a database, generalizing ShapeDNA [RWP06] to work with partialities. Working with eigenvalues allows us to deal with unknown correspondence, different sampling, and different discretizations (point clouds and meshes alike), making this operation especially robust and general. Our approach is data-driven and can generalize to isometric and non-isometric deformations of the surface, as long as these stay within the same semantic class (e.g., human bodies or horses), as well as to partiality artifacts not seen at training time.

Data assimilation is the process of fusing information from imperfect computer simulations with noisy, sparse measurements of reality to obtain improved estimates of the state or parameters of a dynamical system of interest. The data assimilation procedures used in many geoscience applications, such as numerical weather forecasting, are variants of the our-dimensional variational (4D-Var) algorithm. The cost of solving the underlying 4D-Var optimization problem is dominated by the cost of repeated forward and adjoint model runs. This motivates substituting the evaluations of the physical model and its adjoint by fast, approximate surrogate models. Neural networks offer a promising approach for the data-driven creation of surrogate models. The accuracy of the surrogate 4D-Var solution depends on the accuracy with each the surrogate captures both the forward and the adjoint model dynamics. We formulate and analyze several approaches to incorporate adjoint information into the construction of neural network surrogates. The resulting networks are tested on unseen data and in a sequential data assimilation problem using the Lorenz-63 system. Surrogates constructed using adjoint information demonstrate superior performance on the 4D-Var data assimilation problem compared to a standard neural network surrogate that uses only forward dynamics information.

We address the problem of unsupervised domain adaptation when the source domain differs from the target domain because of a shift in the distribution of a latent subgroup. When this subgroup confounds all observed data, neither covariate shift nor label shift assumptions apply. We show that the optimal target predictor can be non-parametrically identified with the help of concept and proxy variables available only in the source domain, and unlabeled data from the target. The identification results are constructive, immediately suggesting an algorithm for estimating the optimal predictor in the target. For continuous observations, when this algorithm becomes impractical, we propose a latent variable model specific to the data generation process at hand. We show how the approach degrades as the size of the shift changes, and verify that it outperforms both covariate and label shift adjustment.

Nine language-vision AI models trained on web scrapes with the Contrastive Language-Image Pretraining (CLIP) objective are evaluated for evidence of a bias studied by psychologists: the sexual objectification of girls and women, which occurs when a person's human characteristics are disregarded and the person is treated as a body or a collection of body parts. A first experiment uses standardized images of women from the Sexual OBjectification and EMotion Database, and finds that, commensurate with prior research in psychology, human characteristics are disassociated from images of objectified women: the model's recognition of emotional state is mediated by whether the subject is fully or partially clothed. Embedding association tests (EATs) return significant effect sizes for both anger (d >.8) and sadness (d >.5). A second experiment measures the effect in a representative application: an automatic image captioner (Antarctic Captions) includes words denoting emotion less than 50% as often for images of partially clothed women than for images of fully clothed women. A third experiment finds that images of female professionals (scientists, doctors, executives) are likely to be associated with sexual descriptions relative to images of male professionals. A fourth experiment shows that a prompt of "a [age] year old girl" generates sexualized images (as determined by an NSFW classifier) up to 73% of the time for VQGAN-CLIP (age 17), and up to 40% of the time for Stable Diffusion (ages 14 and 18); the corresponding rate for boys never surpasses 9%. The evidence indicates that language-vision AI models trained on automatically collected web scrapes learn biases of sexual objectification, which propagate to downstream applications.

The estimation of cumulative distribution functions (CDFs) is an important learning task with a great variety of downstream applications, such as risk assessments in predictions and decision making. In this paper, we study functional regression of contextual CDFs where each data point is sampled from a linear combination of context dependent CDF basis functions. We propose functional ridge-regression-based estimation methods that estimate CDFs accurately everywhere. In particular, given $n$ samples with $d$ basis functions, we show estimation error upper bounds of $\widetilde{O}(\sqrt{d/n})$ for fixed design, random design, and adversarial context cases. We also derive matching information theoretic lower bounds, establishing minimax optimality for CDF functional regression. Furthermore, we remove the burn-in time in the random design setting using an alternative penalized estimator. Then, we consider agnostic settings where there is a mismatch in the data generation process. We characterize the error of the proposed estimators in terms of the mismatched error, and show that the estimators are well-behaved under model mismatch. Finally, to complete our study, we formalize infinite dimensional models where the parameter space is an infinite dimensional Hilbert space, and establish self-normalized estimation error upper bounds for this setting.

Assessing breast cancer risk from imaging remains a subjective process, in which radiologists employ simple computer aided detection (CAD) systems or qualitative visual assessment to estimate breast percent density (PD). Machine learning (ML) models have become the most promising way to quantify breast cancer risk for early, accurate, and equitable diagnoses, but training such models in medical research is often restricted to small, single-institution data. Since patient demographics and imaging characteristics may vary considerably across imaging sites, models trained on single-institution data tend not to generalize well. In response to this problem, MammoDL is proposed, an open-source software tool that leverages a U-Net architecture to accurately estimate breast PD and complexity from mammography. With the Open Federated Learning (OpenFL) library, this solution enables secure training on datasets across multiple institutions. MammoDL is a leaner, more flexible model than its predecessors, boasting improved generalization due to federation-enabled training on larger, more representative datasets.

In this paper, we consider the computational complexity of bounding the reachable set of a Linear Time-Invariant (LTI) system controlled by a Rectified Linear Unit (ReLU) Two-Level Lattice (TLL) Neural Network (NN) controller. In particular, we show that for such a system and controller, it is possible to compute the exact one-step reachable set in polynomial time in the size of the TLL NN controller (number of neurons). Additionally, we show that a tight bounding box of the reachable set is computable via two polynomial-time methods: one with polynomial complexity in the size of the TLL and the other with polynomial complexity in the Lipschitz constant of the controller and other problem parameters. Finally, we propose a pragmatic algorithm that adaptively combines the benefits of (semi-)exact reachability and approximate reachability, which we call L-TLLBox. We evaluate L-TLLBox with an empirical comparison to a state-of-the-art NN controller reachability tool. In our experiments, L-TLLBox completed reachability analysis as much as 5000x faster than this tool on the same network/system, while producing reach boxes that were from 0.08 to 1.42 times the area.

We introduce a tunable loss function called $\alpha$-loss, parameterized by $\alpha \in (0,\infty]$, which interpolates between the exponential loss ($\alpha = 1/2$), the log-loss ($\alpha = 1$), and the 0-1 loss ($\alpha = \infty$), for the machine learning setting of classification. Theoretically, we illustrate a fundamental connection between $\alpha$-loss and Arimoto conditional entropy, verify the classification-calibration of $\alpha$-loss in order to demonstrate asymptotic optimality via Rademacher complexity generalization techniques, and build-upon a notion called strictly local quasi-convexity in order to quantitatively characterize the optimization landscape of $\alpha$-loss. Practically, we perform class imbalance, robustness, and classification experiments on benchmark image datasets using convolutional-neural-networks. Our main practical conclusion is that certain tasks may benefit from tuning $\alpha$-loss away from log-loss ($\alpha = 1$), and to this end we provide simple heuristics for the practitioner. In particular, navigating the $\alpha$ hyperparameter can readily provide superior model robustness to label flips ($\alpha > 1$) and sensitivity to imbalanced classes ($\alpha < 1$).

Responding with multi-modal content has been recognized as an essential capability for an intelligent conversational agent. In this paper, we introduce the MMDialog dataset to better facilitate multi-modal conversation. MMDialog is composed of a curated set of 1.08 million real-world dialogues with 1.53 million unique images across 4,184 topics. MMDialog has two main and unique advantages. First, it is the largest multi-modal conversation dataset by the number of dialogues by 88x. Second, it contains massive topics to generalize the open-domain. To build engaging dialogue system with this dataset, we propose and normalize two response producing tasks based on retrieval and generative scenarios. In addition, we build two baselines for above tasks with state-of-the-art techniques and report their experimental performance. We also propose a novel evaluation metric MM-Relevance to measure the multi-modal responses. Our dataset and scripts are available in https://github.com/victorsungo/MMDialog.

The following article presents a memetic algorithm with applying deep reinforcement learning (DRL) for solving practically oriented dual resource constrained flexible job shop scheduling problems (DRC-FJSSP). In recent years, there has been extensive research on DRL techniques, but without considering realistic, flexible and human-centered shopfloors. A research gap can be identified in the context of make-to-order oriented discontinuous manufacturing as it is often represented in medium-size companies with high service levels. From practical industry projects in this domain, we recognize requirements to depict flexible machines, human workers and capabilities, setup and processing operations, material arrival times, complex job paths with parallel tasks for bill of material (BOM) manufacturing, sequence-depended setup times and (partially) automated tasks. On the other hand, intensive research has been done on metaheuristics in the context of DRC-FJSSP. However, there is a lack of suitable and generic scheduling methods that can be holistically applied in sociotechnical production and assembly processes. In this paper, we first formulate an extended DRC-FJSSP induced by the practical requirements mentioned. Then we present our proposed hybrid framework with parallel computing for multicriteria optimization. Through numerical experiments with real-world data, we confirm that the framework generates feasible schedules efficiently and reliably. Utilizing DRL instead of random operations leads to better results and outperforms traditional approaches.

Electroplated diamond abrasive tools require nickel coating on a metal surface for abrasive bonding and part functionality. The electroplated nickel-coated abrasive tool is expected to have a high-quality part performance by having a nickel coating thickness of between 50% to 60% of the abrasive median diameter, uniformity of the nickel layer, abrasive distribution over the electroplated surface, and bright gloss. Electroplating parameters are set accordingly for this purpose. Industrial quality inspection for defects of these abrasive electroplated parts with optical inspection instruments is extremely challenging due to the diamond's light refraction, dispersion nature, and reflective bright nickel surface. The difficulty posed by this challenge requires parts to be quality inspected manually with an eye loupe that is subjective and costly. In this study, we use a Convolutional Neural Network (CNN) model in the production line to detect abrasive electroplated part anomalies allowing us to fix or eliminate those parts or elements that are in bad condition from the production chain and ultimately reduce manual quality inspection cost. We used 744 samples to train our model. Our model successfully identified over 99% of the parts with an anomaly. Keywords: Artificial Intelligence, Anomaly Detection, Industrial Quality Inspection, Electroplating, Diamond Abrasive Tool

Problem statement: Standardisation of AI fairness rules and benchmarks is challenging because AI fairness and other ethical requirements depend on multiple factors such as context, use case, type of the AI system, and so on. In this paper, we elaborate that the AI system is prone to biases at every stage of its lifecycle, from inception to its usage, and that all stages require due attention for mitigating AI bias. We need a standardised approach to handle AI fairness at every stage. Gap analysis: While AI fairness is a hot research topic, a holistic strategy for AI fairness is generally missing. Most researchers focus only on a few facets of AI model-building. Peer review shows excessive focus on biases in the datasets, fairness metrics, and algorithmic bias. In the process, other aspects affecting AI fairness get ignored. The solution proposed: We propose a comprehensive approach in the form of a novel seven-layer model, inspired by the Open System Interconnection (OSI) model, to standardise AI fairness handling. Despite the differences in the various aspects, most AI systems have similar model-building stages. The proposed model splits the AI system lifecycle into seven abstraction layers, each corresponding to a well-defined AI model-building or usage stage. We also provide checklists for each layer and deliberate on potential sources of bias in each layer and their mitigation methodologies. This work will facilitate layer-wise standardisation of AI fairness rules and benchmarking parameters.

We consider the problem of federated learning in a one-shot setting in which there are $m$ machines, each observing $n$ sample functions from an unknown distribution on non-convex loss functions. Let $F:[-1,1]^d\rightarrow\mathbb{R}$ be the expected loss function with respect to this unknown distribution. The goal is to find an estimate of the minimizer of $F$. Based on its observations, each machine generates a signal of bounded length $B$ and sends it to a server. The server collects signals of all machines and outputs an estimate of the minimizer of $F$. We show that the expected loss of any algorithm is lower bounded by $\max\big(1/(\sqrt{n}(mB)^{1/d}), 1/\sqrt{mn}\big)$, up to a logarithmic factor. We then prove that this lower bound is order optimal in $m$ and $n$ by presenting a distributed learning algorithm, called Multi-Resolution Estimator for Non-Convex loss function (MRE-NC), whose expected loss matches the lower bound for large $mn$ up to polylogarithmic factors.

We are witnessing the emergence of an AI economy and society where AI technologies are increasingly impacting health care, business, transportation and many aspects of everyday life. Many successes have been reported where AI systems even surpassed the accuracy of human experts. However, AI systems may produce errors, can exhibit bias, may be sensitive to noise in the data, and often lack technical and judicial transparency resulting in reduction in trust and challenges in their adoption. These recent shortcomings and concerns have been documented in scientific but also in general press such as accidents with self driving cars, biases in healthcare, hiring and face recognition systems for people of color, seemingly correct medical decisions later found to be made due to wrong reasons etc. This resulted in emergence of many government and regulatory initiatives requiring trustworthy and ethical AI to provide accuracy and robustness, some form of explainability, human control and oversight, elimination of bias, judicial transparency and safety. The challenges in delivery of trustworthy AI systems motivated intense research on explainable AI systems (XAI). Aim of XAI is to provide human understandable information of how AI systems make their decisions. In this paper we first briefly summarize current XAI work and then challenge the recent arguments of accuracy vs. explainability for being mutually exclusive and being focused only on deep learning. We then present our recommendations for the use of XAI in full lifecycle of high stakes trustworthy AI systems delivery, e.g. development, validation and certification, and trustworthy production and maintenance.

Over the decades, traditional outlier detectors have ignored the group-level factor when calculating outlier scores for objects in data by evaluating only the object-level factor, failing to capture the collective outliers. To mitigate this issue, we present a method called neighborhood representative (NR), which empowers all the existing outlier detectors to efficiently detect outliers, including collective outliers, while maintaining their computational integrity. It achieves this by selecting representative objects, scoring these objects, then applies the score of the representative objects to its collective objects. Without altering existing detectors, NR is compatible with existing detectors, while improving performance on real world datasets with +8% (0.72 to 0.78 AUC) relative to state-of-the-art outlier detectors.

An increasing amount of research is being devoted to applying machine learning methods to electronic health record (EHR) data for various clinical purposes. This growing area of research has exposed the challenges of the accessibility of EHRs. MIMIC is a popular, public, and free EHR dataset in a raw format that has been used in numerous studies. The absence of standardized pre-processing steps can be, however, a significant barrier to the wider adoption of this rare resource. Additionally, this absence can reduce the reproducibility of the developed tools and limit the ability to compare the results among similar studies. In this work, we provide a greatly customizable pipeline to extract, clean, and pre-process the data available in the fourth version of the MIMIC dataset (MIMIC-IV). The pipeline also presents an end-to-end wizard-like package supporting predictive model creations and evaluations. The pipeline covers a range of clinical prediction tasks which can be broadly classified into four categories - readmission, length of stay, mortality, and phenotype prediction. The tool is publicly available at https://github.com/healthylaife/MIMIC-IV-Data-Pipeline.

In this work, we propose a robust framework that employs adversarially robust training to safeguard the machine learning models against perturbed testing data. We achieve this by incorporating the worst-case additive adversarial error within a fixed budget for each sample during model estimation. Our main focus is to provide a plug-and-play solution that can be incorporated in the existing machine learning algorithms with minimal changes. To that end, we derive the ready-to-use solution for several widely used loss functions with a variety of norm constraints on adversarial perturbation for various supervised and unsupervised ML problems, including regression, classification, two-layer neural networks, graphical models, and matrix completion. The solutions are either in closed-form, 1-D optimization, semidefinite programming, difference of convex programming or a sorting-based algorithm. Finally, we validate our approach by showing significant performance improvement on real-world datasets for supervised problems such as regression and classification, as well as for unsupervised problems such as matrix completion and learning graphical models, with very little computational overhead.

We propose an accurate method for removing thermal vibrations that complicate the task of analyzing complex dynamics in atomistic simulation of condensed matter. Our method iteratively subtracts thermal noises or perturbations in atomic positions using a denoising score function trained on synthetically noised but otherwise perfect crystal lattices. The resulting denoised structures clearly reveal underlying crystal order while retaining disorder associated with crystal defects. Purely geometric, agnostic to interatomic potentials, and trained without inputs from explicit simulations, our denoiser can be applied to simulation data generated from vastly different interatomic interactions. Followed by a simple phase classification tool such as the Common Neighbor Analysis, the denoiser outperforms other existing methods and reaches perfect classification accuracy on a recently proposed benchmark dataset consisting of perturbed crystal structures (DC3). Demonstrated here in a wide variety of atomistic simulation contexts, the denoiser is general, robust, and readily extendable to delineate order from disorder in structurally and chemically complex materials.

The deployment flexibility and maneuverability of Unmanned Aerial Vehicles (UAVs) increased their adoption in various applications, such as wildfire tracking, border monitoring, etc. In many critical applications, UAVs capture images and other sensory data and then send the captured data to remote servers for inference and data processing tasks. However, this approach is not always practical in real-time applications due to the connection instability, limited bandwidth, and end-to-end latency. One promising solution is to divide the inference requests into multiple parts (layers or segments), with each part being executed in a different UAV based on the available resources. Furthermore, some applications require the UAVs to traverse certain areas and capture incidents; thus, planning their paths becomes critical particularly, to reduce the latency of making the collaborative inference process. Specifically, planning the UAVs trajectory can reduce the data transmission latency by communicating with devices in the same proximity while mitigating the transmission interference. This work aims to design a model for distributed collaborative inference requests and path planning in a UAV swarm while respecting the resource constraints due to the computational load and memory usage of the inference requests. The model is formulated as an optimization problem and aims to minimize latency. The formulated problem is NP-hard so finding the optimal solution is quite complex; thus, this paper introduces a real-time and dynamic solution for online applications using deep reinforcement learning. We conduct extensive simulations and compare our results to the-state-of-the-art studies demonstrating that our model outperforms the competing models.

Use of graphs to represent molecular crystals has become popular in recent years as they provide a natural translation from atoms and bonds to nodes and edges. Graphs capture structure, while remaining invariant to the symmetries that crystals display. Several works in property prediction, including those with state-of-the-art results, make use of the Crystal Graph. The present work offers a graph based on Point-wise Distance Distributions which retains symmetrical invariance, decreases computational load, and yields similar or better prediction accuracy on both experimental and simulated crystals.

Many applications of representation learning, such as privacy preservation, algorithmic fairness, and domain adaptation, desire explicit control over semantic information being discarded. This goal is formulated as satisfying two objectives: maximizing utility for predicting a target attribute while simultaneously being invariant (independent) to a known semantic attribute. Solutions to invariant representation learning (IRepL) problems lead to a trade-off between utility and invariance when they are competing. While existing works study bounds on this trade-off, two questions remain outstanding: 1) What is the exact trade-off between utility and invariance? and 2) What are the encoders (mapping the data to a representation) that achieve the trade-off, and how can we estimate it from training data? This paper addresses these questions for IRepLs in reproducing kernel Hilbert spaces (RKHS)s. Under the assumption that the distribution of a low-dimensional projection of high-dimensional data is approximately normal, we derive a closed-form solution for the global optima of the underlying optimization problem for encoders in RKHSs. This yields closed formulae for a near-optimal trade-off, corresponding optimal representation dimensionality, and the corresponding encoder(s). We also numerically quantify the trade-off on representative problems and compare them to those achieved by baseline IRepL algorithms.

In today's online advertising markets, an important demand for an advertiser (buyer) is to control her total expenditure within a time span under some budget. Among all budget control approaches, throttling stands out as a popular one, where the buyer chooses to participate in only a part of auctions. This paper gives a theoretical panorama of a single buyer's dynamic budget throttling process in repeated second-price auctions, which is lacking in the literature. We first establish a lower bound on the regret and an upper bound on the asymptotic competitive ratio for any algorithm, respectively, on whether the buyer's values are stochastic or adversarial. Second, on the algorithmic side, we consider two different information structures, with increasing difficulty in learning the stochastic distribution of the highest competing bid. We further propose the OGD-CB algorithm, which is oblivious to whether the values are stochastic or adversarial and has asymptotically equal results under these two information structures. Specifically, with stochastic values, we demonstrate that this algorithm guarantees a near-optimal expected regret. When values are adversarial, we prove that the proposed algorithm reaches the upper bound on the asymptotic competitive ratio. At last, we compare throttling with pacing, another widely adopted budget control method, in the dynamic setting. In the stochastic case, we illustrate that dynamic pacing is generally better than dynamic throttling for the buyer, which is an extension of known results that dynamic pacing is asymptotically optimal in this scenario. However, in the adversarial case, we give an exciting result indicating that dynamic throttling is the asymptotically optimal dynamic bidding strategy. Our results fill the gaps in the theoretical research of dynamic throttling and comprehensively reveal the ability of this popular budget-smoothing strategy.

Neural Architecture Search (NAS) has significantly improved productivity in the design and deployment of neural networks (NN). As NAS typically evaluates multiple models by training them partially or completely, the improved productivity comes at the cost of significant carbon footprint. To alleviate this expensive training routine, zero-shot/cost proxies analyze an NN at initialization to generate a score, which correlates highly with its true accuracy. Zero-cost proxies are currently designed by experts conducting multiple cycles of empirical testing on possible algorithms, datasets, and neural architecture design spaces. This experimentation lowers productivity and is an unsustainable approach towards zero-cost proxy design as deep learning use-cases diversify in nature. Additionally, existing zero-cost proxies fail to generalize across neural architecture design spaces. In this paper, we propose a genetic programming framework to automate the discovery of zero-cost proxies for neural architecture scoring. Our methodology efficiently discovers an interpretable and generalizable zero-cost proxy that gives state of the art score-accuracy correlation on all datasets and search spaces of NASBench-201 and Network Design Spaces (NDS). We believe that this research indicates a promising direction towards automatically discovering zero-cost proxies that can work across network architecture design spaces, datasets, and tasks.

Finding the mounting angle of a smartphone inside a car is crucial for navigation, motion detection, activity recognition, and other applications. It is a challenging task in several aspects: (i) the mounting angle at the drive start is unknown and may differ significantly between users; (ii) the user, or bad fixture, may change the mounting angle while driving; (iii) a rapid and computationally efficient real-time solution is required for most applications. To tackle these problems, a data-driven approach using deep neural networks (DNNs) is presented to learn the yaw mounting angle of a smartphone equipped with an inertial measurement unit (IMU) and strapped to a car. The proposed model, MountNet, uses only IMU readings as input and, in contrast to existing solutions, does not require inputs from global navigation satellite systems (GNSS). IMU data is collected for training and validation with the sensor mounted at a known yaw mounting angle and a range of ground truth labels is generated by applying a prescribed rotation to the measurements. Although the training data did not include recordings with real sensor rotations, tests on data with real and synthetic rotations show similar results. An algorithm is formulated for real-time deployment to detect and smooth transitions in device mounting angle estimated by MountNet. MountNet is shown to find the mounting angle rapidly which is critical in real-time applications. Our method converges in less than 30 seconds of driving to a mean error of 4 degrees allowing a fast calibration phase for other algorithms and applications. When the device is rotated in the middle of a drive, large changes converge in 5 seconds and small changes converge in less than 30 seconds.

To mitigate climate change, the share of renewable needs to be increased. Renewable energies introduce new challenges to power grids due to decentralization, reduced inertia and volatility in production. The operation of sustainable power grids with a high penetration of renewable energies requires new methods to analyze the dynamic stability. We provide new datasets of dynamic stability of synthetic power grids and find that graph neural networks (GNNs) are surprisingly effective at predicting the highly non-linear target from topological information only. To illustrate the potential to scale to real-sized power grids, we demonstrate the successful prediction on a Texan power grid model.

We propose a notation for tensors with named axes, which relieves the author, reader, and future implementers of machine learning models from the burden of keeping track of the order of axes and the purpose of each. The notation makes it easy to lift operations on low-order tensors to higher order ones, for example, from images to minibatches of images, or from an attention mechanism to multiple attention heads. After a brief overview and formal definition of the notation, we illustrate it through several examples from modern machine learning, from building blocks like attention and convolution to full models like Transformers and LeNet. We then discuss differential calculus in our notation and compare with some alternative notations. Our proposals build on ideas from many previous papers and software libraries. We hope that our notation will encourage more authors to use named tensors, resulting in clearer papers and more precise implementations.

Humans and animals can learn new skills after practicing for a few hours, while current reinforcement learning algorithms require a large amount of data to achieve good performances. Recent model-based approaches show promising results by reducing the number of necessary interactions with the environment to learn a desirable policy. However, these methods require biological implausible ingredients, such as the detailed storage of older experiences, and long periods of offline learning. The optimal way to learn and exploit word-models is still an open question. Taking inspiration from biology, we suggest that dreaming might be an efficient expedient to use an inner model. We propose a two-module (agent and model) spiking neural network in which "dreaming" (living new experiences in a model-based simulated environment) significantly boosts learning. We also explore "planning", an online alternative to dreaming, that shows comparable performances. Importantly, our model does not require the detailed storage of experiences, and learns online the world-model and the policy. Moreover, we stress that our network is composed of spiking neurons, further increasing the biological plausibility and implementability in neuromorphic hardware.

We study experiment design for unique identification of the causal graph of a system where the graph may contain cycles. The presence of cycles in the structure introduces major challenges for experiment design as, unlike acyclic graphs, learning the skeleton of causal graphs with cycles may not be possible from merely the observational distribution. Furthermore, intervening on a variable in such graphs does not necessarily lead to orienting all the edges incident to it. In this paper, we propose an experiment design approach that can learn both cyclic and acyclic graphs and hence, unifies the task of experiment design for both types of graphs. We provide a lower bound on the number of experiments required to guarantee the unique identification of the causal graph in the worst case, showing that the proposed approach is order-optimal in terms of the number of experiments up to an additive logarithmic term. Moreover, we extend our result to the setting where the size of each experiment is bounded by a constant. For this case, we show that our approach is optimal in terms of the size of the largest experiment required for uniquely identifying the causal graph in the worst case.

A large number of annotated video-caption pairs are required for training video captioning models, resulting in high annotation costs. Active learning can be instrumental in reducing these annotation requirements. However, active learning for video captioning is challenging because multiple semantically similar captions are valid for a video, resulting in high entropy outputs even for less-informative samples. Moreover, video captioning algorithms are multimodal in nature with a visual encoder and language decoder. Further, the sequential and combinatorial nature of the output makes the problem even more challenging. In this paper, we introduce MAViC which leverages our proposed Multimodal Semantics Aware Sequential Entropy (M-SASE) based acquisition function to address the challenges of active learning approaches for video captioning. Our approach integrates semantic similarity and uncertainty of both visual and language dimensions in the acquisition function. Our detailed experiments empirically demonstrate the efficacy of M-SASE for active learning for video captioning and improve on the baselines by a large margin.

The core issue in semi-supervised learning (SSL) lies in how to effectively leverage unlabeled data, whereas most existing methods tend to put a great emphasis on the utilization of high-confidence samples yet seldom fully explore the usage of low-confidence samples. In this paper, we aim to utilize low-confidence samples in a novel way with our proposed mutex-based consistency regularization, namely MutexMatch. Specifically, the high-confidence samples are required to exactly predict "what it is" by conventional True-Positive Classifier, while the low-confidence samples are employed to achieve a simpler goal -- to predict with ease "what it is not" by True-Negative Classifier. In this sense, we not only mitigate the pseudo-labeling errors but also make full use of the low-confidence unlabeled data by consistency of dissimilarity degree. MutexMatch achieves superior performance on multiple benchmark datasets, i.e., CIFAR-10, CIFAR-100, SVHN, STL-10, mini-ImageNet and Tiny-ImageNet. More importantly, our method further shows superiority when the amount of labeled data is scarce, e.g., 92.23% accuracy with only 20 labeled data on CIFAR-10. Our code and model weights have been released at https://github.com/NJUyued/MutexMatch4SSL.

Remarkable progress has been achieved in synthesizing photo-realistic images with generative adversarial networks (GANs). Recently, GANs are utilized as the training sample generator when obtaining or storing real training data is expensive even infeasible. However, traditional GANs generated images are not as informative as the real training samples when being used to train deep neural networks. In this paper, we propose a novel method to synthesize Informative Training samples with GAN (IT-GAN). Specifically, we freeze a pre-trained GAN model and learn the informative latent vectors that correspond to informative training samples. The synthesized images are required to preserve information for training deep neural networks rather than visual reality or fidelity. Experiments verify that the deep neural networks can learn faster and achieve better performance when being trained with our IT-GAN generated images. We also show that our method is a promising solution to dataset condensation problem.

Answering complex logical queries on incomplete knowledge graphs is a challenging task, and has been widely studied. Embedding-based methods require training on complex queries, and cannot generalize well to out-of-distribution query structures. Recent work frames this task as an end-to-end optimization problem, and it only requires a pretrained link predictor. However, due to the exponentially large combinatorial search space, the optimal solution can only be approximated, limiting the final accuracy. In this work, we propose QTO (Query Computation Tree Optimization) that can efficiently find the exact optimal solution. QTO finds the optimal solution by a forward-backward propagation on the tree-like computation graph, i.e., query computation tree. In particular, QTO utilizes the independence encoded in the query computation tree to reduce the search space, where only local computations are involved during the optimization procedure. Experiments on 3 datasets show that QTO obtains state-of-the-art performance on complex query answering, outperforming previous best results by an average of 22%. Moreover, QTO can interpret the intermediate solutions for each of the one-hop atoms in the query with over 90% accuracy.

Efforts to improve the adversarial robustness of convolutional neural networks have primarily focused on developing more effective adversarial training methods. In contrast, little attention was devoted to analyzing the role of architectural elements (such as topology, depth, and width) on adversarial robustness. This paper seeks to bridge this gap and present a holistic study on the impact of architectural design on adversarial robustness. We focus on residual networks and consider architecture design at the block level, i.e., topology, kernel size, activation, and normalization, as well as at the network scaling level, i.e., depth and width of each block in the network. In both cases, we first derive insights through systematic ablative experiments. Then we design a robust residual block, dubbed RobustResBlock, and a compound scaling rule, dubbed RobustScaling, to distribute depth and width at the desired FLOP count. Finally, we combine RobustResBlock and RobustScaling and present a portfolio of adversarially robust residual networks, RobustResNets, spanning a broad spectrum of model capacities. Experimental validation across multiple datasets and adversarial attacks demonstrate that RobustResNets consistently outperform both the standard WRNs and other existing robust architectures, achieving state-of-the-art AutoAttack robust accuracy of 61.1% without additional data and 63.7% with 500K external data while being $2\times$ more compact in terms of parameters. Code is available at \url{ https://github.com/zhichao-lu/robust-residual-network}

The advancements in machine learning opened a new opportunity to bring intelligence to the low-end Internet-of-Things nodes such as microcontrollers. Conventional machine learning deployment has high memory and compute footprint hindering their direct deployment on ultra resource-constrained microcontrollers. This paper highlights the unique requirements of enabling onboard machine learning for microcontroller class devices. Researchers use a specialized model development workflow for resource-limited applications to ensure the compute and latency budget is within the device limits while still maintaining the desired performance. We characterize a closed-loop widely applicable workflow of machine learning model development for microcontroller class devices and show that several classes of applications adopt a specific instance of it. We present both qualitative and numerical insights into different stages of model development by showcasing several use cases. Finally, we identify the open research challenges and unsolved questions demanding careful considerations moving forward.

This work presents a thorough review concerning recent studies and text generation advancements using Generative Adversarial Networks. The usage of adversarial learning for text generation is promising as it provides alternatives to generate the so-called "natural" language. Nevertheless, adversarial text generation is not a simple task as its foremost architecture, the Generative Adversarial Networks, were designed to cope with continuous information (image) instead of discrete data (text). Thus, most works are based on three possible options, i.e., Gumbel-Softmax differentiation, Reinforcement Learning, and modified training objectives. All alternatives are reviewed in this survey as they present the most recent approaches for generating text using adversarial-based techniques. The selected works were taken from renowned databases, such as Science Direct, IEEEXplore, Springer, Association for Computing Machinery, and arXiv, whereas each selected work has been critically analyzed and assessed to present its objective, methodology, and experimental results.

Classification data sets with skewed class proportions are called imbalanced. Class imbalance is a problem since most machine learning classification algorithms are built with an assumption of equal representation of all classes in the training dataset. Therefore to counter the class imbalance problem, many algorithm-level and data-level approaches have been developed. These mainly include ensemble learning and data augmentation techniques. This paper shows a new way to counter the class imbalance problem through a new data-splitting strategy called balanced split. Data splitting can play an important role in correctly classifying imbalanced datasets. We show that the commonly used data-splitting strategies have some disadvantages, and our proposed balanced split has solved those problems.

In the context of an efficient network traffic engineering process where the network continuously measures a new traffic matrix and updates the set of paths in the network, an automated process is required to quickly and efficiently identify when and what set of paths should be used. Unfortunately, the burden of finding the optimal solution for the network updating process in each given time interval is high since the computation complexity of optimization approaches using linear programming increases significantly as the size of the network increases. In this paper, we use deep reinforcement learning to derive a data-driven algorithm that does the path selection in the network considering the overhead of route computation and path updates. Our proposed scheme leverages information about past network behavior to identify a set of robust paths to be used for multiple future time intervals to avoid the overhead of updating the forwarding behavior of routers frequently. We compare the results of our approach to other traffic engineering solutions through extensive simulations across real network topologies. Our results demonstrate that our scheme fares well by a factor of 40% with respect to reducing link utilization compared to traditional TE schemes such as ECMP. Our scheme provides a slightly higher link utilization (around 25%) compared to schemes that only minimize link utilization and do not care about path updating overhead.

In this paper, we consider the problem of adjusting the exploration rate when using value-of-information-based exploration. We do this by converting the value-of-information optimization into a problem of finding equilibria of a flow for a changing exploration rate. We then develop an efficient path-following scheme for converging to these equilibria and hence uncovering optimal action-selection policies. Under this scheme, the exploration rate is automatically adapted according to the agent's experiences. Global convergence is theoretically assured. We first evaluate our exploration-rate adaptation on the Nintendo GameBoy games Centipede and Millipede. We demonstrate aspects of the search process. We show that our approach yields better policies in fewer episodes than conventional search strategies relying on heuristic, annealing-based exploration-rate adjustments. We then illustrate that these trends hold for deep, value-of-information-based agents that learn to play ten simple games and over forty more complicated games for the Nintendo GameBoy system. Performance either near or well above the level of human play is observed.

Convex function constrained optimization has received growing research interests lately. For a special convex problem which has strongly convex function constraints, we develop a new accelerated primal-dual first-order method that obtains an $\Ocal(1/\sqrt{\vep})$ complexity bound, improving the $\Ocal(1/{\vep})$ result for the state-of-the-art first-order methods. The key ingredient to our development is some novel techniques to progressively estimate the strong convexity of the Lagrangian function, which enables adaptive step-size selection and faster convergence performance. In addition, we show that the complexity is further improvable in terms of the dependence on some problem parameter, via a restart scheme that calls the accelerated method repeatedly. As an application, we consider sparsity-inducing constrained optimization which has a separable convex objective and a strongly convex loss constraint. In addition to achieving fast convergence, we show that the restarted method can effectively identify the sparsity pattern (active-set) of the optimal solution in finite steps. To the best of our knowledge, this is the first active-set identification result for sparsity-inducing constrained optimization.

This article presents our generative model for rhythm action games together with applications in business operations. Rhythm action games are video games in which the player is challenged to issue commands at the right timings during a music session. The timings are rendered in the chart, which consists of visual symbols, called notes, flying through the screen. We introduce our deep generative model, Gen\'eLive!, which outperforms the state-of-the-art model by taking into account musical structures through beats and temporal scales. Thanks to its favorable performance, Gen\'eLive! was put into operation at KLab Inc., a Japan-based video game developer, and reduced the business cost of chart generation by as much as half. The application target included the phenomenal "Love Live!," which has more than 10 million users across Asia and beyond, and is one of the few rhythm action franchises that has led the online era of the genre. In this article, we evaluate the generative performance of Gen\'eLive! using production datasets at KLab as well as open datasets for reproducibility, while the model continues to operate in their business. Our code and the model, tuned and trained using a supercomputer, are publicly available.

Mining user-generated data often suffers from the lack of enough labeled data, short document lengths, and the informal user language. In this paper, we propose a novel active learning model to overcome these obstacles in the tasks tailored for query phrases--e.g., detecting positive reports of natural disasters. Our model has three novelties: 1) It is the first approach to employ multi-view active learning in this domain. 2) It uses the Parzen-Rosenblatt window method to integrate the representativeness measure into multi-view active learning. 3) It employs a query-by-committee strategy, based on the agreement between predictors, to address the usually noisy language of the documents in this domain. We evaluate our model in four publicly available Twitter datasets with distinctly different applications. We also compare our model with a wide range of baselines including those with multiple classifiers. The experiments testify that our model is highly consistent and outperforms existing models.

Multiclass classification (MCC) is a fundamental machine learning problem of classifying each instance into one of a predefined set of classes. In the deep learning era, extensive efforts have been spent on developing more powerful neural embedding models to better represent the instance for improving MCC performance. In this paper, we do not aim to propose new neural models for instance representation learning, but to show that it is promising to boost MCC performance with a novel formulation through the lens of ranking. In particular, by viewing MCC as to rank classes for an instance, we first argue that ranking metrics, such as Normalized Discounted Cumulative Gain, can be more informative than the commonly used Top-$K$ metrics. We further demonstrate that the dominant neural MCC recipe can be transformed to a neural ranking framework. Based on such generalization, we show that it is intuitive to leverage advanced techniques from the learning to rank literature to improve the MCC performance out of the box. Extensive empirical results on both text and image classification tasks with diverse datasets and backbone neural models show the value of our proposed framework.

A phishing attack is a sort of cyber assault in which the attacker sends fake communications to entice a human victim to provide personal information or credentials. Phishing website identification can assist visitors in avoiding becoming victims of these assaults. The phishing problem is increasing day by day, and there is no single solution that can properly mitigate all vulnerabilities, thus many techniques are used. In this paper, We have proposed an ensemble model that combines multiple base models with a voting technique based on the weights. Moreover, we applied feature selection methods and standardization on the dataset effectively and compared the result before and after applying any feature selection.

Question-and-answer formats provide a novel experimental platform for investigating cybersecurity questions. Unlike previous chatbots, the latest ChatGPT model from OpenAI supports an advanced understanding of complex coding questions. The research demonstrates thirteen coding tasks that generally qualify as stages in the MITRE ATT&CK framework, ranging from credential access to defense evasion. With varying success, the experimental prompts generate examples of keyloggers, logic bombs, obfuscated worms, and payment-fulfilled ransomware. The empirical results illustrate cases that support the broad gain of functionality, including self-replication and self-modification, evasion, and strategic understanding of complex cybersecurity goals. One surprising feature of ChatGPT as a language-only model centers on its ability to spawn coding approaches that yield images that obfuscate or embed executable programming steps or links.

Novel plant communities reshape landscapes and pose challenges for land cover classification and mapping that can constrain research and stewardship efforts. In the US Northeast, emergence of low-statured woody vegetation, or shrublands, instead of secondary forests in post-agricultural landscapes is well-documented by field studies, but poorly understood from a landscape perspective, which limits the ability to systematically study and manage these lands. To address gaps in classification/mapping of low-statured cover types where they have been historically rare, we developed models to predict shrubland distributions at 30m resolution across New York State (NYS), using a stacked ensemble combining a random forest, gradient boosting machine, and artificial neural network to integrate remote sensing of structural (airborne LIDAR) and optical (satellite imagery) properties of vegetation cover. We first classified a 1m canopy height model (CHM), derived from a patchwork of available LIDAR coverages, to define shrubland presence/absence. Next, these non-contiguous maps were used to train a model ensemble based on temporally-segmented imagery to predict shrubland probability for the entire study landscape (NYS). Approximately 2.5% of the CHM coverage area was classified as shrubland. Models using Landsat predictors trained on the classified CHM were effective at identifying shrubland (test set AUC=0.893, real-world AUC=0.904), in discriminating between shrub/young forest and other cover classes, and produced qualitatively sensible maps, even when extending beyond the original training data. Our results suggest that incorporation of airborne LiDAR, even from a discontinuous patchwork of coverages, can improve land cover classification of historically rare but increasingly prevalent shrubland habitats across broader areas.

Model-based reinforcement learning methods often use learning only for the purpose of estimating an approximate dynamics model, offloading the rest of the decision-making work to classical trajectory optimizers. While conceptually simple, this combination has a number of empirical shortcomings, suggesting that learned models may not be well-suited to standard trajectory optimization. In this paper, we consider what it would look like to fold as much of the trajectory optimization pipeline as possible into the modeling problem, such that sampling from the model and planning with it become nearly identical. The core of our technical approach lies in a diffusion probabilistic model that plans by iteratively denoising trajectories. We show how classifier-guided sampling and image inpainting can be reinterpreted as coherent planning strategies, explore the unusual and useful properties of diffusion-based planning methods, and demonstrate the effectiveness of our framework in control settings that emphasize long-horizon decision-making and test-time flexibility.

This paper presents a novel technique based on gradient boosting to train the final layers of a neural network (NN). Gradient boosting is an additive expansion algorithm in which a series of models are trained sequentially to approximate a given function. A neural network can also be seen as an additive expansion where the scalar product of the responses of the last hidden layer and its weights provide the final output of the network. Instead of training the network as a whole, the proposed algorithm trains the network sequentially in $T$ steps. First, the bias term of the network is initialized with a constant approximation that minimizes the average loss of the data. Then, at each step, a portion of the network, composed of $J$ neurons, is trained to approximate the pseudo-residuals on the training data computed from the previous iterations. Finally, the $T$ partial models and bias are integrated as a single NN with $T \times J$ neurons in the hidden layer. Extensive experiments in classification and regression tasks, as well as in combination with deep neural networks, are carried out showing a competitive generalization performance with respect to neural networks trained with different standard solvers, such as Adam, L-BFGS, SGD and deep models. Furthermore, we show that the proposed method design permits to switch off a number of hidden units during test (the units that were last trained) without a significant reduction of its generalization ability. This permits the adaptation of the model to different classification speed requirements on the fly.

There is increasing adoption of artificial intelligence in drug discovery. However, existing works use machine learning to mainly utilize the chemical structures of molecules yet ignore the vast textual knowledge available in chemistry. Incorporating textual knowledge enables us to realize new drug design objectives, adapt to text-based instructions, and predict complex biological activities. We present a multi-modal molecule structure-text model, MoleculeSTM, by jointly learning molecule's chemical structures and textual descriptions via a contrastive learning strategy. To train MoleculeSTM, we construct the largest multi-modal dataset to date, namely PubChemSTM, with over 280K chemical structure-text pairs. To demonstrate the effectiveness and utility of MoleculeSTM, we design two challenging zero-shot tasks based on text instructions, including structure-text retrieval and molecule editing. MoleculeSTM possesses two main properties: open vocabulary and compositionality via natural language. In experiments, MoleculeSTM obtains the state-of-the-art generalization ability to novel biochemical concepts across various benchmarks.

Reservoir Computing is an emerging machine learning framework which is a versatile option for utilising physical systems for computation. In this paper, we demonstrate how a single node reservoir, made of a simple electronic circuit, can be employed for computation and explore the available options to improve the computational capability of the physical reservoirs. We build a reservoir computing system using a memristive chaotic oscillator as the reservoir. We choose two of the available hyperparameters to find the optimal working regime for the reservoir, resulting in two reservoir versions. We compare the performance of both the reservoirs in a set of three non-temporal tasks: approximating two non-chaotic polynomials and a chaotic trajectory of the Lorenz time series. We also demonstrate how the dynamics of the physical system plays a direct role in the reservoir's hyperparameters and hence in the reservoir's prediction ability.

Decentralized and federated learning algorithms face data heterogeneity as one of the biggest challenges, especially when users want to learn a specific task. Even when personalized headers are used concatenated to a shared network (PF-MTL), aggregating all the networks with a decentralized algorithm can result in performance degradation as a result of heterogeneity in the data. Our algorithm uses exchanged gradients to calculate the correlations among tasks automatically, and dynamically adjusts the communication graph to connect mutually beneficial tasks and isolate those that may negatively impact each other. This algorithm improves the learning performance and leads to faster convergence compared to the case where all clients are connected to each other regardless of their correlations. We conduct experiments on a synthetic Gaussian dataset and a large-scale celebrity attributes (CelebA) dataset. The experiment with the synthetic data illustrates that our proposed method is capable of detecting tasks that are positively and negatively correlated. Moreover, the results of the experiments with CelebA demonstrate that the proposed method may produce significantly faster training results than fully-connected networks.

Data compression is becoming critical for storing scientific data because many scientific applications need to store large amounts of data and post process this data for scientific discovery. Unlike image and video compression algorithms that limit errors to primary data, scientists require compression techniques that accurately preserve derived quantities of interest (QoIs). This paper presents a physics-informed compression technique implemented as an end-to-end, scalable, GPU-based pipeline for data compression that addresses this requirement. Our hybrid compression technique combines machine learning techniques and standard compression methods. Specifically, we combine an autoencoder, an error-bounded lossy compressor to provide guarantees on raw data error, and a constraint satisfaction post-processing step to preserve the QoIs within a minimal error (generally less than floating point error). The effectiveness of the data compression pipeline is demonstrated by compressing nuclear fusion simulation data generated by a large-scale fusion code, XGC, which produces hundreds of terabytes of data in a single day. Our approach works within the ADIOS framework and results in compression by a factor of more than 150 while requiring only a few percent of the computational resources necessary for generating the data, making the overall approach highly effective for practical scenarios.

The Election Commission of India has introduced Voter Verified Paper Audit Trail since 2019. This mechanism has increased voter confidence at the time of casting the votes. However, physical verification of the VVPATs against the party level counts from the EVMs is done only in 5 (randomly selected) machines per constituency. The time required to conduct physical verification becomes a bottleneck in scaling this activity for 100% of machines in all constituencies. We proposed an automated counter powered by image processing and machine learning algorithms to speed up the process and address this issue.

The goal of our research is to create a comprehensive and flexible library that is easy to use for medical imaging research, and capable of handling grayscale images, multiple inputs (both images and tabular data), and multi-label tasks. We have named it Nervus. Based on the PyTorch library, which is suitable for AI for research purposes, we created a four-part model to handle comprehensive inputs and outputs. Nervus consists of four parts. First is the dataloader, then the feature extractor, the feature mixer, and finally the classifier. The dataloader preprocesses the input data, the feature extractor extracts the features between the training data and ground truth labels, feature mixer mixes the features of the extractors, and the classifier classifies the input data from feature mixer based on the task. We have created Nervus, which is a comprehensive and flexible model library that is easy to use for medical imaging research which can handle grayscale images, multi-inputs and multi-label tasks. This will be helpful for researchers in the field of radiology.

We introduce the Bayesian Compiler Optimization framework (BaCO), a general purpose autotuner for modern compilers targeting CPUs, GPUs, and FPGAs. BaCO provides the flexibility needed to handle the requirements of modern autotuning tasks. Particularly, it deals with permutation, ordered, and continuous parameter types along with both known and unknown parameter constraints. To reason about these parameter types and efficiently deliver high-quality code, BaCO uses Bayesian optimization algorithms specialized towards the autotuning domain. We demonstrate BaCO's effectiveness on three modern compiler systems: TACO, RISE & ELEVATE, and HPVM2FPGA for CPUs, GPUs, and FPGAs respectively. For these domains, BaCO outperforms current state-of-the-art autotuners by delivering on average 1.39x-1.89x faster code with a tiny search budget, and BaCO is able to reach expert-level performance 2.89x-8.77x faster.

Off-policy learning is more unstable compared to on-policy learning in reinforcement learning (RL). One reason for the instability of off-policy learning is a discrepancy between the target ($\pi$) and behavior (b) policy distributions. The discrepancy between $\pi$ and b distributions can be alleviated by employing a smooth variant of the importance sampling (IS), such as the relative importance sampling (RIS). RIS has parameter $\beta\in[0, 1]$ which controls smoothness. To cope with instability, we present the first relative importance sampling-off-policy actor-critic (RIS-Off-PAC) model-free algorithms in RL. In our method, the network yields a target policy (the actor), a value function (the critic) assessing the current policy ($\pi$) using samples drawn from behavior policy. We use action value generated from the behavior policy in reward function to train our algorithm rather than from the target policy. We also use deep neural networks to train both actor and critic. We evaluated our algorithm on a number of Open AI Gym benchmark problems and demonstrate better or comparable performance to several state-of-the-art RL baselines.

Modern telecom systems are monitored with performance and system logs from multiple application layers and components. Detecting anomalous events from these logs is key to identify security breaches, resource over-utilization, critical/fatal errors, etc. Current supervised log anomaly detection frameworks tend to perform poorly on new types or signatures of anomalies with few or unseen samples in the training data. In this work, we propose a meta-learning-based log anomaly detection framework (LogAnMeta) for detecting anomalies from sequence of log events with few samples. LoganMeta train a hybrid few-shot classifier in an episodic manner. The experimental results demonstrate the efficacy of our proposed method

Common to all different kinds of recurrent neural networks (RNNs) is the intention to model relations between data points through time. When there is no immediate relationship between subsequent data points (like when the data points are generated at random, e.g.), we show that RNNs are still able to remember a few data points back into the sequence by memorizing them by heart using standard backpropagation. However, we also show that for classical RNNs, LSTM and GRU networks the distance of data points between recurrent calls that can be reproduced this way is highly limited (compared to even a loose connection between data points) and subject to various constraints imposed by the type and size of the RNN in question. This implies the existence of a hard limit (way below the information-theoretic one) for the distance between related data points within which RNNs are still able to recognize said relation.

The field of Automatic Music Generation has seen significant progress thanks to the advent of Deep Learning. However, most of these results have been produced by unconditional models, which lack the ability to interact with their users, not allowing them to guide the generative process in meaningful and practical ways. Moreover, synthesizing music that remains coherent across longer timescales while still capturing the local aspects that make it sound ``realistic'' or ``human-like'' is still challenging. This is due to the large computational requirements needed to work with long sequences of data, and also to limitations imposed by the training schemes that are often employed. In this paper, we propose a generative model of symbolic music conditioned by data retrieved from human sentiment. The model is a Transformer-GAN trained with labels that correspond to different configurations of the valence and arousal dimensions that quantitatively represent human affective states. We try to tackle both of the problems above by employing an efficient linear version of Attention and using a Discriminator both as a tool to improve the overall quality of the generated music and its ability to follow the conditioning signals.

Given the success with in-context learning of large pre-trained language models, we introduce in-context learning distillation to transfer in-context few-shot learning ability from large models to smaller models. We propose to combine in-context learning objectives with language modeling objectives to distill both the ability to read in-context examples and task knowledge to the smaller models. We perform in-context learning distillation under two different few-shot learning paradigms: Meta In-context Tuning (Meta-ICT) and Multitask In-context Tuning (Multitask-ICT). Multitask-ICT performs better on multitask few-shot learning but also requires more computation than Meta-ICT. Our method shows consistent improvements for both Meta-ICT and Multitask-ICT on two benchmarks: LAMA and CrossFit. Our extensive experiments and analysis reveal that in-context learning objectives and language modeling objectives are complementary under the Multitask-ICT paradigm. In-context learning objectives achieve the best performance when combined with language modeling objectives.

As machine learning expanding application, there are more and more unignorable privacy and safety issues. Especially inference attacks against Machine Learning models allow adversaries to infer sensitive information about the target model, such as training data, model parameters, etc. Inference attacks can lead to serious consequences, including violating individuals privacy, compromising the intellectual property of the owner of the machine learning model. As far as concerned, researchers have studied and analyzed in depth several types of inference attacks, albeit in isolation, but there is still a lack of a holistic rick assessment of inference attacks against machine learning models, such as their application in different scenarios, the common factors affecting the performance of these attacks and the relationship among the attacks. As a result, this paper performs a holistic risk assessment of different inference attacks against Machine Learning models. This paper focuses on three kinds of representative attacks: membership inference attack, attribute inference attack and model stealing attack. And a threat model taxonomy is established. A total of 12 target models using three model architectures, including AlexNet, ResNet18 and Simple CNN, are trained on four datasets, namely CelebA, UTKFace, STL10 and FMNIST.

Recently, there has been an interest in improving the resources available in Intrusion Detection System (IDS) techniques. In this sense, several studies related to cybersecurity show that the environment invasions and information kidnapping are increasingly recurrent and complex. The criticality of the business involving operations in an environment using computing resources does not allow the vulnerability of the information. Cybersecurity has taken on a dimension within the universe of indispensable technology in corporations, and the prevention of risks of invasions into the environment is dealt with daily by Security teams. Thus, the main objective of the study was to investigate the Ensemble Learning technique using the Stacking method, supported by the Support Vector Machine (SVM) and k-Nearest Neighbour (kNN) algorithms aiming at an optimization of the results for DDoS attack detection. For this, the Intrusion Detection System concept was used with the application of the Data Mining and Machine Learning Orange tool to obtain better results

In recent years, there have been abundant researches focused on indoor human presence detection based on laborious supervised learning (SL) and channel state information (CSI). These existing studies adopt spatial information of CSI to improve detection accuracy. However, channel is susceptible to arbitrary environmental changes in practice, such as the object movement, atmospheric factors and machine rebooting, which leads to degraded prediction accuracy. However, the existing SL-based methods require to re-train a new model with time-consuming labeling. Therefore, designing a semi-supervised learning (SSL) based scheme by continuously monitoring model "life-cycle" becomes compellingly imperative. In this paper, we propose bifold teacher-student (BTS) learning for presence detection system, which combines SSL by utilizing partial labeled and unlabeled dataset. The proposed primal-dual teacher-student network is capable of intelligently learning spatial and temporal features from labeled and unlabeled CSI. Additionally, the enhanced penalized loss function leveraging entropy and distance measure can distinguish the drifted data, i.e., features of new dataset are affected by time-varying effect and are alternated from the original distribution. The experimental results demonstrate that the proposed BTS system can sustain the asymptotic accuracy after retraining the model with unlabeled data. Moreover, label-free BTS outperforms the existing SSL-based models in terms of the highest detection accuracy, while achieving the similar performance of SL-based methods.

Contrastive representation learning has proven to be an effective self-supervised learning method for images and videos. Most successful approaches are based on Noise Contrastive Estimation (NCE) and use different views of an instance as positives that should be contrasted with other instances, called negatives, that are considered as noise. However, several instances in a dataset are drawn from the same distribution and share underlying semantic information. A good data representation should contain relations between the instances, or semantic similarity and dissimilarity, that contrastive learning harms by considering all negatives as noise. To circumvent this issue, we propose a novel formulation of contrastive learning using semantic similarity between instances called Similarity Contrastive Estimation (SCE). Our training objective is a soft contrastive one that brings the positives closer and estimates a continuous distribution to push or pull negative instances based on their learned similarities. We validate empirically our approach on both image and video representation learning. We show that SCE performs competitively with the state of the art on the ImageNet linear evaluation protocol for fewer pretraining epochs and that it generalizes to several downstream image tasks. We also show that SCE reaches state-of-the-art results for pretraining video representation and that the learned representation can generalize to video downstream tasks.

Data augmentation (DA) is indispensable in modern machine learning and deep neural networks. The basic idea of DA is to construct new training data to improve the model's generalization by adding slightly disturbed versions of existing data or synthesizing new data. In this work, we review a small but essential subset of DA -- Mix-based Data Augmentation (MixDA) that generates novel samples by mixing multiple examples. Unlike conventional DA approaches based on a single-sample operation or requiring domain knowledge, MixDA is more general in creating a broad spectrum of new data and has received increasing attention in the community. We begin with proposing a new taxonomy classifying MixDA into, Mixup-based, Cutmix-based, and hybrid approaches according to a hierarchical view of the data mix. Various MixDA techniques are then comprehensively reviewed in a more fine-grained way. Owing to its generalization, MixDA has penetrated a variety of applications which are also completely reviewed in this work. We also examine why MixDA works from different aspects of improving model performance, generalization, and calibration while explaining the model behavior based on the properties of MixDA. Finally, we recapitulate the critical findings and fundamental challenges of current MixDA studies, and outline the potential directions for future works. Different from previous related works that summarize the DA approaches in a specific domain (e.g., images or natural language processing) or only review a part of MixDA studies, we are the first to provide a systematical survey of MixDA in terms of its taxonomy, methodology, applications, and explainability. This work can serve as a roadmap to MixDA techniques and application reviews while providing promising directions for researchers interested in this exciting area.

Domain adaptation aims to transfer the knowledge acquired by models trained on (data-rich) source domains to (low-resource) target domains, for which a popular method is invariant representation learning. While they have been studied extensively for classification and regression problems, how they apply to ranking problems, where the data and metrics have a list structure, is not well understood. Theoretically, we establish a domain adaptation generalization bound for ranking under listwise metrics such as MRR and NDCG. The bound suggests an adaptation method via learning list-level domain-invariant feature representations, whose benefits are empirically demonstrated by unsupervised domain adaptation experiments on real-world ranking tasks, including passage reranking. A key message is that for domain adaptation, the representations should be analyzed at the same level at which the metric is computed, as we show that learning invariant representations at the list level is most effective for adaptation on ranking problems.

This paper introduces a novel method of adding intrinsic bonuses to task-oriented reward function in order to efficiently facilitate reinforcement learning search. While various bonuses have been designed to date, they are analogous to the depth-first and breadth-first search algorithms in graph theory. This paper, therefore, first designs two bonuses for each of them. Then, a heuristic gain scheduling is applied to the designed bonuses, inspired by the iterative deepening search, which is known to inherit the advantages of the two search algorithms. The proposed method is expected to allow agent to efficiently reach the best solution in deeper states by gradually exploring unknown states. In three locomotion tasks with dense rewards and three simple tasks with sparse rewards, it is shown that the two types of bonuses contribute to the performance improvement of the different tasks complementarily. In addition, by combining them with the proposed gain scheduling, all tasks can be accomplished with high performance.

A recent explosion of research focuses on developing methods and tools for building fair predictive models. However, most of this work relies on the assumption that the training and testing data are representative of the target population on which the model will be deployed. However, real-world training data often suffer from selection bias and are not representative of the target population for many reasons, including the cost and feasibility of collecting and labeling data, historical discrimination, and individual biases. In this paper, we introduce a new framework for certifying and ensuring the fairness of predictive models trained on biased data. We take inspiration from query answering over incomplete and inconsistent databases to present and formalize the problem of consistent range approximation (CRA) of answers to queries about aggregate information for the target population. We aim to leverage background knowledge about the data collection process, biased data, and limited or no auxiliary data sources to compute a range of answers for aggregate queries over the target population that are consistent with available information. We then develop methods that use CRA of such aggregate queries to build predictive models that are certifiably fair on the target population even when no external information about that population is available during training. We evaluate our methods on real data and demonstrate improvements over state of the art. Significantly, we show that enforcing fairness using our methods can lead to predictive models that are not only fair, but more accurate on the target population.

Deploying machine learning models in production may allow adversaries to infer sensitive information about training data. There is a vast literature analyzing different types of inference risks, ranging from membership inference to reconstruction attacks. Inspired by the success of games (i.e., probabilistic experiments) to study security properties in cryptography, some authors describe privacy inference risks in machine learning using a similar game-based style. However, adversary capabilities and goals are often stated in subtly different ways from one presentation to the other, which makes it hard to relate and compose results. In this paper, we present a game-based framework to systematize the body of knowledge on privacy inference risks in machine learning.

This paper highlights vulnerabilities of deep learning-driven semantic communications to backdoor (Trojan) attacks. Semantic communications aims to convey a desired meaning while transferring information from a transmitter to its receiver. An encoder-decoder pair that is represented by two deep neural networks (DNNs) as part of an autoencoder is trained to reconstruct signals such as images at the receiver by transmitting latent features of small size over a limited number of channel uses. In the meantime, another DNN of a semantic task classifier at the receiver is jointly trained with the autoencoder to check the meaning conveyed to the receiver. The complex decision space of the DNNs makes semantic communications susceptible to adversarial manipulations. In a backdoor (Trojan) attack, the adversary adds triggers to a small portion of training samples and changes the label to a target label. When the transfer of images is considered, the triggers can be added to the images or equivalently to the corresponding transmitted or received signals. In test time, the adversary activates these triggers by providing poisoned samples as input to the encoder (or decoder) of semantic communications. The backdoor attack can effectively change the semantic information transferred for the poisoned input samples to a target meaning. As the performance of semantic communications improves with the signal-to-noise ratio and the number of channel uses, the success of the backdoor attack increases as well. Also, increasing the Trojan ratio in training data makes the attack more successful. In the meantime, the effect of this attack on the unpoisoned input samples remains limited. Overall, this paper shows that the backdoor attack poses a serious threat to semantic communications and presents novel design guidelines to preserve the meaning of transferred information in the presence of backdoor attacks.

Reinforcement Learning is a powerful tool to model decision-making processes. However, it relies on an exploration-exploitation trade-off that remains an open challenge for many tasks. In this work, we study neighboring state-based, model-free exploration led by the intuition that, for an early-stage agent, considering actions derived from a bounded region of nearby states may lead to better actions when exploring. We propose two algorithms that choose exploratory actions based on a survey of nearby states, and find that one of our methods, ${\rho}$-explore, consistently outperforms the Double DQN baseline in an discrete environment by 49\% in terms of Eval Reward Return.

Counterfactual explanation is a common class of methods to make local explanations of machine learning decisions. For a given instance, these methods aim to find the smallest modification of feature values that changes the predicted decision made by a machine learning model. One of the challenges of counterfactual explanation is the efficient generation of realistic counterfactuals. To address this challenge, we propose VCNet-Variational Counter Net-a model architecture that combines a predictor and a counterfactual generator that are jointly trained, for regression or classification tasks. VCNet is able to both generate predictions, and to generate counterfactual explanations without having to solve another minimisation problem. Our contribution is the generation of counterfactuals that are close to the distribution of the predicted class. This is done by learning a variational autoencoder conditionally to the output of the predictor in a join-training fashion. We present an empirical evaluation on tabular datasets and across several interpretability metrics. The results are competitive with the state-of-the-art method.

Molecular representation learning is crucial for the problem of molecular property prediction, where graph neural networks (GNNs) serve as an effective solution due to their structure modeling capabilities. Since labeled data is often scarce and expensive to obtain, it is a great challenge for GNNs to generalize in the extensive molecular space. Recently, the training paradigm of "pre-train, fine-tune" has been leveraged to improve the generalization capabilities of GNNs. It uses self-supervised information to pre-train the GNN, and then performs fine-tuning to optimize the downstream task with just a few labels. However, pre-training does not always yield statistically significant improvement, especially for self-supervised learning with random structural masking. In fact, the molecular structure is characterized by motif subgraphs, which are frequently occurring and influence molecular properties. To leverage the task-related motifs, we propose a novel paradigm of "pre-train, prompt, fine-tune" for molecular representation learning, named molecule continuous prompt tuning (MolCPT). MolCPT defines a motif prompting function that uses the pre-trained model to project the standalone input into an expressive prompt. The prompt effectively augments the molecular graph with meaningful motifs in the continuous representation space; this provides more structural patterns to aid the downstream classifier in identifying molecular properties. Extensive experiments on several benchmark datasets show that MolCPT efficiently generalizes pre-trained GNNs for molecular property prediction, with or without a few fine-tuning steps.

As of 2022, greenhouse gases (GHG) emissions reporting and auditing are not yet compulsory for all companies and methodologies of measurement and estimation are not unified. We propose a machine learning-based model to estimate scope 1 and scope 2 GHG emissions of companies not reporting them yet. Our model, specifically designed to be transparent and completely adapted to this use case, is able to estimate emissions for a large universe of companies. It shows good out-of-sample global performances as well as good out-of-sample granular performances when evaluating it by sectors, by countries or by revenues buckets. We also compare our results to those of other providers and find our estimates to be more accurate. Thanks to the proposed explainability tools using Shapley values, our model is fully interpretable, the user being able to understand which factors split explain the GHG emissions for each particular company.

With its capability to deal with graph data, which is widely found in practical applications, graph neural networks (GNNs) have attracted significant research attention in recent years. As societies become increasingly concerned with the need for data privacy protection, GNNs face the need to adapt to this new normal. Besides, as clients in Federated Learning (FL) may have relationships, more powerful tools are required to utilize such implicit information to boost performance. This has led to the rapid development of the emerging research field of federated graph neural networks (FedGNNs). This promising interdisciplinary field is highly challenging for interested researchers to grasp. The lack of an insightful survey on this topic further exacerbates the entry difficulty. In this paper, we bridge this gap by offering a comprehensive survey of this emerging field. We propose a 2-dimensional taxonomy of the FedGNNs literature: 1) the main taxonomy provides a clear perspective on the integration of GNNs and FL by analyzing how GNNs enhance FL training as well as how FL assists GNNs training, and 2) the auxiliary taxonomy provides a view on how FedGNNs deal with heterogeneity across FL clients. Through discussions of key ideas, challenges, and limitations of existing works, we envision future research directions that can help build more robust, explainable, efficient, fair, inductive, and comprehensive FedGNNs.

Drug repositioning holds great promise because it can reduce the time and cost of new drug development. While drug repositioning can omit various R&D processes, confirming pharmacological effects on biomolecules is essential for application to new diseases. Biomedical explainability in a drug repositioning model can support appropriate insights in subsequent in-depth studies. However, the validity of the XAI methodology is still under debate, and the effectiveness of XAI in drug repositioning prediction applications remains unclear. In this study, we propose GraphIX, an explainable drug repositioning framework using biological networks, and quantitatively evaluate its explainability. GraphIX first learns the network weights and node features using a graph neural network from known drug indication and knowledge graph that consists of three types of nodes (but not given node type information): disease, drug, and protein. Analysis of the post-learning features showed that node types that were not known to the model beforehand are distinguished through the learning process based on the graph structure. From the learned weights and features, GraphIX then predicts the disease-drug association and calculates the contribution values of the nodes located in the neighborhood of the predicted disease and drug. We hypothesized that the neighboring protein node to which the model gave a high contribution is important in understanding the actual pharmacological effects. Quantitative evaluation of the validity of protein nodes' contribution using a real-world database showed that the high contribution proteins shown by GraphIX are reasonable as a mechanism of drug action. GraphIX is a framework for evidence-based drug discovery that can present to users new disease-drug associations and identify the protein important for understanding its pharmacological effects from a large and complex knowledge base.

Active learning as a paradigm in deep learning is especially important in applications involving intricate perception tasks such as object detection where labels are difficult and expensive to acquire. Development of active learning methods in such fields is highly computationally expensive and time consuming which obstructs the progression of research and leads to a lack of comparability between methods. In this work, we propose and investigate a sandbox setup for rapid development and transparent evaluation of active learning in deep object detection. Our experiments with commonly used configurations of datasets and detection architectures found in the literature show that results obtained in our sandbox environment are representative of results on standard configurations. The total compute time to obtain results and assess the learning behavior can thereby be reduced by factors of up to 14 when comparing with Pascal VOC and up to 32 when comparing with BDD100k. This allows for testing and evaluating data acquisition and labeling strategies in under half a day and contributes to the transparency and development speed in the field of active learning for object detection.

It is crucial for the service provider to comprehend and forecast mobile traffic in large-scale cellular networks in order to govern and manage mechanisms for base station placement, load balancing, and network planning. The purpose of this article is to extract and simulate traffic patterns from more than 14,000 cells that have been installed in different metropolitan areas. To do this, we create, implement, and assess a method in which cells are first categorized by their point of interest and then clustered based on the temporal distribution of cells in each region. The proposed model has been tested using real-world 5G mobile traffic datasets collected over 31 weeks in various cities. We found that our proposed model performed well in predicting mobile traffic patterns up to 2 weeks in advance. Our model outperformed the base model in most areas of interest and generally achieved up to 15\% less prediction error compared to the na\"ive approach. This indicates that our approach is effective in predicting mobile traffic patterns in large-scale cellular networks.

Pre-trained large language models can efficiently interpolate human-written prompts in a natural way. Multitask prompted learning can help generalization through a diverse set of tasks at once, thus enhancing the potential for more effective downstream fine-tuning. To perform efficient multitask-inference in the same batch, parameter-efficient fine-tuning methods such as prompt tuning have been proposed. However, the existing prompt tuning methods may lack generalization. We propose SPT, a semi-parametric prompt tuning method for multitask prompted learning. The novel component of SPT is a memory bank from where memory prompts are retrieved based on discrete prompts. Extensive experiments, such as (i) fine-tuning a full language model with SPT on 31 different tasks from 8 different domains and evaluating zero-shot generalization on 9 heldout datasets under 5 NLP task categories and (ii) pretraining SPT on the GLUE datasets and evaluating fine-tuning on the SuperGLUE datasets, demonstrate effectiveness of SPT.

Automatic Text Summarization (ATS) is becoming relevant with the growth of textual data; however, with the popularization of public large-scale datasets, some recent machine learning approaches have focused on dense models and architectures that, despite producing notable results, usually turn out in models difficult to interpret. Given the challenge behind interpretable learning-based text summarization and the importance it may have for evolving the current state of the ATS field, this work studies the application of two modern Generalized Additive Models with interactions, namely Explainable Boosting Machine and GAMI-Net, to the extractive summarization problem based on linguistic features and binary classification.

Although Reinforcement Learning (RL) has shown impressive results in games and simulation, real-world application of RL suffers from its instability under changing environment conditions and hyperparameters. We give a first impression of the extent of this instability by showing that the hyperparameters found by automatic hyperparameter optimization (HPO) methods are not only dependent on the problem at hand, but even on how well the state describes the environment dynamics. Specifically, we show that agents in contextual RL require different hyperparameters if they are shown how environmental factors change. In addition, finding adequate hyperparameter configurations is not equally easy for both settings, further highlighting the need for research into how hyperparameters influence learning and generalization in RL.

We prove that for $c>0$ a sufficiently small universal constant that a random set of $c d^2/\log^4(d)$ independent Gaussian random points in $\mathbb{R}^d$ lie on a common ellipsoid with high probability. This nearly establishes a conjecture of~\cite{SaundersonCPW12}, within logarithmic factors. The latter conjecture has attracted significant attention over the past decade, due to its connections to machine learning and sum-of-squares lower bounds for certain statistical problems.

The core operation of current Graph Neural Networks (GNNs) is the aggregation enabled by the graph Laplacian or message passing, which filters the neighborhood information of nodes. Though effective for various tasks, in this paper, we show that they are potentially a problematic factor underlying all GNN models for learning on certain datasets, as they force the node representations similar, making the nodes gradually lose their identity and become indistinguishable. Hence, we augment the aggregation operations with their dual, i.e. diversification operators that make the node more distinct and preserve the identity. Such augmentation replaces the aggregation with a two-channel filtering process that, in theory, is beneficial for enriching the node representations. In practice, the proposed two-channel filters can be easily patched on existing GNN methods with diverse training strategies, including spectral and spatial (message passing) methods. In the experiments, we observe desired characteristics of the models and significant performance boost upon the baselines on 9 node classification tasks.

Relation Extraction (RE) has been extended to cross-document scenarios because many relations are not simply described in a single document. This inevitably brings the challenge of efficient open-space evidence retrieval to support the inference of cross-document relations, along with the challenge of multi-hop reasoning on top of entities and evidence scattered in an open set of documents. To combat these challenges, we propose Mr.CoD, a multi-hop evidence retrieval method based on evidence path mining and ranking with adapted dense retrievers. We explore multiple variants of retrievers to show evidence retrieval is an essential part in cross-document RE. Experiments on CodRED show that evidence retrieval with Mr.Cod effectively acquires cross-document evidence that essentially supports open-setting cross-document RE. Additionally, we show that Mr.CoD facilitates evidence retrieval and boosts end-to-end RE performance with effective multi-hop reasoning in both closed and open settings of RE.

We describe a Physics-Informed Neural Network (PINN) that simulates the flow induced by the astronomical tide in a synthetic port channel, with dimensions based on the Santos - S\~ao Vicente - Bertioga Estuarine System. PINN models aim to combine the knowledge of physical systems and data-driven machine learning models. This is done by training a neural network to minimize the residuals of the governing equations in sample points. In this work, our flow is governed by the Navier-Stokes equations with some approximations. There are two main novelties in this paper. First, we design our model to assume that the flow is periodic in time, which is not feasible in conventional simulation methods. Second, we evaluate the benefit of resampling the function evaluation points during training, which has a near zero computational cost and has been verified to improve the final model, especially for small batch sizes. Finally, we discuss some limitations of the approximations used in the Navier-Stokes equations regarding the modeling of turbulence and how it interacts with PINNs.

2048 is a single-player stochastic puzzle game. This intriguing and addictive game has been popular worldwide and has attracted researchers to develop game-playing programs. Due to its simplicity and complexity, 2048 has become an interesting and challenging platform for evaluating the effectiveness of machine learning methods. This dissertation conducts comprehensive research on reinforcement learning and computer game algorithms for 2048. First, this dissertation proposes optimistic temporal difference learning, which significantly improves the quality of learning by employing optimistic initialization to encourage exploration for 2048. Furthermore, based on this approach, a state-of-the-art program for 2048 is developed, which achieves the highest performance among all learning-based programs, namely an average score of 625377 points and a rate of 72% for reaching 32768-tiles. Second, this dissertation investigates several techniques related to 2048, including the n-tuple network ensemble learning, Monte Carlo tree search, and deep reinforcement learning. These techniques are promising for further improving the performance of the current state-of-the-art program. Finally, this dissertation discusses pedagogical applications related to 2048 by proposing course designs and summarizing the teaching experience. The proposed course designs use 2048-like games as materials for beginners to learn reinforcement learning and computer game algorithms. The courses have been successfully applied to graduate-level students and received well by student feedback.

Automating hardware design could obviate a significant amount of human error from the engineering process and lead to fewer errors. Verilog is a popular hardware description language to model and design digital systems, thus generating Verilog code is a critical first step. Emerging large language models (LLMs) are able to write high-quality code in other programming languages. In this paper, we characterize the ability of LLMs to generate useful Verilog. For this, we fine-tune pre-trained LLMs on Verilog datasets collected from GitHub and Verilog textbooks. We construct an evaluation framework comprising test-benches for functional analysis and a flow to test the syntax of Verilog code generated in response to problems of varying difficulty. Our findings show that across our problem scenarios, the fine-tuning results in LLMs more capable of producing syntactically correct code (25.9% overall). Further, when analyzing functional correctness, a fine-tuned open-source CodeGen LLM can outperform the state-of-the-art commercial Codex LLM (6.5% overall). Training/evaluation scripts and LLM checkpoints are available: https://github.com/shailja-thakur/VGen.

Automatic video captioning aims for a holistic visual scene understanding. It requires a mechanism for capturing temporal context in video frames and the ability to comprehend the actions and associations of objects in a given timeframe. Such a system should additionally learn to abstract video sequences into sensible representations as well as to generate natural written language. While the majority of captioning models focus solely on the visual inputs, little attention has been paid to the audiovisual modality. To tackle this issue, we propose a novel two-fold approach. First, we implement a reward-guided KL Divergence to train a video captioning model which is resilient towards token permutations. Second, we utilise a Bi-Modal Hierarchical Reinforcement Learning (BMHRL) Transformer architecture to capture long-term temporal dependencies of the input data as a foundation for our hierarchical captioning module. Using our BMHRL, we show the suitability of the HRL agent in the generation of content-complete and grammatically sound sentences by achieving $4.91$, $2.23$, and $10.80$ in BLEU3, BLEU4, and METEOR scores, respectively on the ActivityNet Captions dataset. Finally, we make our BMHRL framework and trained models publicly available for users and developers at https://github.com/d-rothen/bmhrl.

Diffusion models have achieved justifiable popularity by attaining state-of-the-art performance in generating realistic objects from seemingly arbitrarily complex data distributions, including when conditioning generation on labels. Unfortunately, however, their iterative nature renders them very computationally inefficient during the sampling process. For the multi-class conditional generation problem, we propose a novel, structurally unique framework of diffusion models which are hierarchically branched according to the inherent relationships between classes. In this work, we demonstrate that branched diffusion models offer major improvements in efficiently generating samples from multiple classes. We also showcase several other advantages of branched diffusion models, including ease of extension to novel classes in a continual-learning setting, and a unique interpretability that offers insight into these generative models. Branched diffusion models represent an alternative paradigm to their traditional linear counterparts, and can have large impacts in how we use diffusion models for efficient generation, online learning, and scientific discovery.

Machine learning (ML) algorithms are remarkably good at approximating complex non-linear relationships. Most ML training processes, however, are designed to deliver ML tools with good average performance, but do not offer any guarantees about their worst-case estimation error. For safety-critical systems such as power systems, this places a major barrier for their adoption. So far, approaches could determine the worst-case violations of only trained ML algorithms. To the best of our knowledge, this is the first paper to introduce a neural network training procedure designed to achieve both a good average performance and minimum worst-case violations. Using the Optimal Power Flow (OPF) problem as a guiding application, our approach (i) introduces a framework that reduces the worst-case generation constraint violations during training, incorporating them as a differentiable optimization layer; and (ii) presents a neural network sequential learning architecture to significantly accelerate it. We demonstrate the proposed architecture on four different test systems ranging from 39 buses to 162 buses, for both AC-OPF and DC-OPF applications.

While deep learning succeeds in a wide range of tasks, it highly depends on the massive collection of annotated data which is expensive and time-consuming. To lower the cost of data annotation, active learning has been proposed to interactively query an oracle to annotate a small proportion of informative samples in an unlabeled dataset. Inspired by the fact that the samples with higher loss are usually more informative to the model than the samples with lower loss, in this paper we present a novel deep active learning approach that queries the oracle for data annotation when the unlabeled sample is believed to incorporate high loss. The core of our approach is a measurement Temporal Output Discrepancy (TOD) that estimates the sample loss by evaluating the discrepancy of outputs given by models at different optimization steps. Our theoretical investigation shows that TOD lower-bounds the accumulated sample loss thus it can be used to select informative unlabeled samples. On basis of TOD, we further develop an effective unlabeled data sampling strategy as well as an unsupervised learning criterion for active learning. Due to the simplicity of TOD, our methods are efficient, flexible, and task-agnostic. Extensive experimental results demonstrate that our approach achieves superior performances than the state-of-the-art active learning methods on image classification and semantic segmentation tasks. In addition, we show that TOD can be utilized to select the best model of potentially the highest testing accuracy from a pool of candidate models.

Machine learning approaches are widely studied in the production prediction of CBM wells after hydraulic fracturing, but merely used in practice due to the low generalization ability and the lack of interpretability. A novel methodology is proposed in this article to discover the latent causality from observed data, which is aimed at finding an indirect way to interpret the machine learning results. Based on the theory of causal discovery, a causal graph is derived with explicit input, output, treatment and confounding variables. Then, SHAP is employed to analyze the influence of the factors on the production capability, which indirectly interprets the machine learning models. The proposed method can capture the underlying nonlinear relationship between the factors and the output, which remedies the limitation of the traditional machine learning routines based on the correlation analysis of factors. The experiment on the data of CBM shows that the detected relationship between the production and the geological/engineering factors by the presented method, is coincident with the actual physical mechanism. Meanwhile, compared with traditional methods, the interpretable machine learning models have better performance in forecasting production capability, averaging 20% improvement in accuracy.

Deploying graph neural networks (GNNs) on whole-graph classification or regression tasks is known to be challenging: it often requires computing node features that are mindful of both local interactions in their neighbourhood and the global context of the graph structure. GNN architectures that navigate this space need to avoid pathological behaviours, such as bottlenecks and oversquashing, while ideally having linear time and space complexity requirements. In this work, we propose an elegant approach based on propagating information over expander graphs. We leverage an efficient method for constructing expander graphs of a given size, and use this insight to propose the EGP model. We show that EGP is able to address all of the above concerns, while requiring minimal effort to set up, and provide evidence of its empirical utility on relevant graph classification datasets and baselines in the Open Graph Benchmark. Importantly, using expander graphs as a template for message passing necessarily gives rise to negative curvature. While this appears to be counterintuitive in light of recent related work on oversquashing, we theoretically demonstrate that negatively curved edges are likely to be required to obtain scalable message passing without bottlenecks. To the best of our knowledge, this is a previously unstudied result in the context of graph representation learning, and we believe our analysis paves the way to a novel class of scalable methods to counter oversquashing in GNNs.

This paper analyzes $\ell_1$ regularized linear regression under the challenging scenario of having only adversarially corrupted data for training. We use the primal-dual witness paradigm to provide provable performance guarantees for the support of the estimated regression parameter vector to match the actual parameter. Our theoretical analysis shows the counter-intuitive result that an adversary can influence sample complexity by corrupting the irrelevant features, i.e., those corresponding to zero coefficients of the regression parameter vector, which, consequently, do not affect the dependent variable. As any adversarially robust algorithm has its limitations, our theoretical analysis identifies the regimes under which the learning algorithm and adversary can dominate over each other. It helps us to analyze these fundamental limits and address critical scientific questions of which parameters (like mutual incoherence, the maximum and minimum eigenvalue of the covariance matrix, and the budget of adversarial perturbation) play a role in the high or low probability of success of the LASSO algorithm. Also, the derived sample complexity is logarithmic with respect to the size of the regression parameter vector, and our theoretical claims are validated by empirical analysis on synthetic and real-world datasets.

Lifelong learning aims to create AI systems that continuously and incrementally learn during a lifetime, similar to biological learning. Attempts so far have met problems, including catastrophic forgetting, interference among tasks, and the inability to exploit previous knowledge. While considerable research has focused on learning multiple input distributions, typically in classification, lifelong reinforcement learning (LRL) must also deal with variations in the state and transition distributions, and in the reward functions. Modulating masks, recently developed for classification, are particularly suitable to deal with such a large spectrum of task variations. In this paper, we adapted modulating masks to work with deep LRL, specifically PPO and IMPALA agents. The comparison with LRL baselines in both discrete and continuous RL tasks shows competitive performance. We further investigated the use of a linear combination of previously learned masks to exploit previous knowledge when learning new tasks: not only is learning faster, the algorithm solves tasks that we could not otherwise solve from scratch due to extremely sparse rewards. The results suggest that RL with modulating masks is a promising approach to lifelong learning, to the composition of knowledge to learn increasingly complex tasks, and to knowledge reuse for efficient and faster learning.

Cancer is one of the most challenging diseases because of its complexity, variability, and diversity of causes. It has been one of the major research topics over the past decades, yet it is still poorly understood. To this end, multifaceted therapeutic frameworks are indispensable. \emph{Anticancer peptides} (ACPs) are the most promising treatment option, but their large-scale identification and synthesis require reliable prediction methods, which is still a problem. In this paper, we present an intuitive classification strategy that differs from the traditional \emph{black box} method and is based on the well-known statistical theory of \emph{sparse-representation classification} (SRC). Specifically, we create over-complete dictionary matrices by embedding the \emph{composition of the K-spaced amino acid pairs} (CKSAAP). Unlike the traditional SRC frameworks, we use an efficient \emph{matching pursuit} solver instead of the computationally expensive \emph{basis pursuit} solver in this strategy. Furthermore, the \emph{kernel principal component analysis} (KPCA) is employed to cope with non-linearity and dimension reduction of the feature space whereas the \emph{synthetic minority oversampling technique} (SMOTE) is used to balance the dictionary. The proposed method is evaluated on two benchmark datasets for well-known statistical parameters and is found to outperform the existing methods. The results show the highest sensitivity with the most balanced accuracy, which might be beneficial in understanding structural and chemical aspects and developing new ACPs. The Google-Colab implementation of the proposed method is available at the author's GitHub page (\href{https://github.com/ehtisham-Fazal/ACP-Kernel-SRC}{https://github.com/ehtisham-fazal/ACP-Kernel-SRC}).  ( 2 min )

We present a general framework for the garment animation problem through unsupervised deep learning inspired in physically based simulation. Existing trends in the literature already explore this possibility. Nonetheless, these approaches do not handle cloth dynamics. Here, we propose the first methodology able to learn realistic cloth dynamics unsupervisedly, and henceforth, a general formulation for neural cloth simulation. The key to achieve this is to adapt an existing optimization scheme for motion from simulation based methodologies to deep learning. Then, analyzing the nature of the problem, we devise an architecture able to automatically disentangle static and dynamic cloth subspaces by design. We will show how this improves model performance. Additionally, this opens the possibility of a novel motion augmentation technique that greatly improves generalization. Finally, we show it also allows to control the level of motion in the predictions. This is a useful, never seen before, tool for artists. We provide of detailed analysis of the problem to establish the bases of neural cloth simulation and guide future research into the specifics of this domain.

Language models have recently achieved strong performance across a wide range of NLP benchmarks. However, unlike benchmarks, real world tasks are often poorly specified, and agents must deduce the user's intended behavior from a combination of context, instructions, and examples. We investigate how both humans and models behave in the face of such task ambiguity by proposing AmbiBench, a new benchmark of six ambiguously-specified classification tasks. We evaluate humans and models on AmbiBench by seeing how well they identify the intended task using 1) instructions with varying degrees of ambiguity, and 2) different numbers of labeled examples. We find that the combination of model scaling (to 175B parameters) and training with human feedback data enables models to approach or exceed the accuracy of human participants across tasks, but that either one alone is not sufficient. In addition, we show how to dramatically improve the accuracy of language models trained without large-scale human feedback training by finetuning on a small number of ambiguous in-context examples, providing a promising direction for teaching models to generalize well in the face of ambiguity.  ( 2 min )

This paper presents a game theoretic framework for participation and free-riding in federated learning (FL), and determines the Nash equilibrium strategies when FL is executed over wireless links. To support spectrum sensing for NextG communications, FL is used by clients, namely spectrum sensors with limited training datasets and computation resources, to train a wireless signal classifier while preserving privacy. In FL, a client may be free-riding, i.e., it does not participate in FL model updates, if the computation and transmission cost for FL participation is high, and receives the global model (learned by other clients) without incurring a cost. However, the free-riding behavior may potentially decrease the global accuracy due to lack of contribution to global model learning. This tradeoff leads to a non-cooperative game where each client aims to individually maximize its utility as the difference between the global model accuracy and the cost of FL participation. The Nash equilibrium strategies are derived for free-riding probabilities such that no client can unilaterally increase its utility given the strategies of its opponents remain the same. The free-riding probability increases with the FL participation cost and the number of clients, and a significant optimality gap exists in Nash equilibrium with respect to the joint optimization for all clients. The optimality gap increases with the number of clients and the maximum gap is evaluated as a function of the cost. These results quantify the impact of free-riding on the resilience of FL in NextG networks and indicate operational modes for FL participation.

Contrastive learning has been successfully used for retrieval of semantically aligned sentences, but it often requires large batch sizes or careful engineering to work well. In this paper, we instead propose a generative model for learning multilingual text embeddings which can be used to retrieve or score sentence pairs. Our model operates on parallel data in $N$ languages and, through an approximation we introduce, efficiently encourages source separation in this multilingual setting, separating semantic information that is shared between translations from stylistic or language-specific variation. We show careful large-scale comparisons between contrastive and generation-based approaches for learning multilingual text embeddings, a comparison that has not been done to the best of our knowledge despite the popularity of these approaches. We evaluate this method on a suite of tasks including semantic similarity, bitext mining, and cross-lingual question retrieval -- the last of which we introduce in this paper. Overall, our Variational Multilingual Source-Separation Transformer (VMSST) model outperforms both a strong contrastive and generative baseline on these tasks.

Since the representative capacity of graph-based clustering methods is usually limited by the graph constructed on the original features, it is attractive to find whether graph neural networks (GNNs) can be applied to augment the capacity. The core problems mainly come from two aspects: (1) the graph is unavailable in the most clustering scenes so that how to construct high-quality graphs on the non-graph data is usually the most important part; (2) given n samples, the graph-based clustering methods usually consume at least $\mathcal O(n^2)$ time to build graphs and the graph convolution requires nearly $\mathcal O(n^2)$ for a dense graph and $\mathcal O(|\mathcal{E}|)$ for a sparse one with $|\mathcal{E}|$ edges. Accordingly, both graph-based clustering and GNNs suffer from the severe inefficiency problem. To tackle these problems, we propose a novel clustering method, AnchorGAE, with the self-supervised estimation of graph and efficient graph convolution. We first show how to convert a non-graph dataset into a graph dataset, by introducing the generative graph model and anchors. We then show that the constructed bipartite graph can reduce the computational complexity of graph convolution from $\mathcal O(n^2)$ and $\mathcal O(|\mathcal{E}|)$ to $\mathcal O(n)$. The succeeding steps for clustering can be easily designed as $\mathcal O(n)$ operations. Interestingly, the anchors naturally lead to siamese architecture with the help of the Markov process. Furthermore, the estimated bipartite graph is updated dynamically according to the features extracted by GNN, to promote the quality of the graph. However, we theoretically prove that the self-supervised paradigm frequently results in a collapse that often occurs after 2-3 update iterations in experiments, especially when the model is well-trained. A specific strategy is accordingly designed to prevent the collapse.

With the development of experimental quantum technology, quantum control has attracted increasing attention due to the realization of controllable artificial quantum systems. However, because quantum-mechanical systems are often too difficult to analytically deal with, heuristic strategies and numerical algorithms which search for proper control protocols are adopted, and, deep learning, especially deep reinforcement learning (RL), is a promising generic candidate solution for the control problems. Although there have been a few successful applications of deep RL to quantum control problems, most of the existing RL algorithms suffer from instabilities and unsatisfactory reproducibility, and require a large amount of fine-tuning and a large computational budget, both of which limit their applicability. To resolve the issue of instabilities, in this dissertation, we investigate the non-convergence issue of Q-learning. Then, we investigate the weakness of existing convergent approaches that have been proposed, and we develop a new convergent Q-learning algorithm, which we call the convergent deep Q network (C-DQN) algorithm, as an alternative to the conventional deep Q network (DQN) algorithm. We prove the convergence of C-DQN and apply it to the Atari 2600 benchmark. We show that when DQN fail, C-DQN still learns successfully. Then, we apply the algorithm to the measurement-feedback cooling problems of a quantum quartic oscillator and a trapped quantum rigid body. We establish the physical models and analyse their properties, and we show that although both C-DQN and DQN can learn to cool the systems, C-DQN tends to behave more stably, and when DQN suffers from instabilities, C-DQN can achieve a better performance. As the performance of DQN can have a large variance and lack consistency, C-DQN can be a better choice for researches on complicated control problems.

The detection of anomalies in time series data is crucial in a wide range of applications, such as system monitoring, health care or cyber security. While the vast number of available methods makes selecting the right method for a certain application hard enough, different methods have different strengths, e.g. regarding the type of anomalies they are able to find. In this work, we compare six unsupervised anomaly detection methods with different complexities to answer the questions: Are the more complex methods usually performing better? And are there specific anomaly types that those method are tailored to? The comparison is done on the UCR anomaly archive, a recent benchmark dataset for anomaly detection. We compare the six methods by analyzing the experimental results on a dataset- and anomaly type level after tuning the necessary hyperparameter for each method. Additionally we examine the ability of individual methods to incorporate prior knowledge about the anomalies and analyse the differences of point-wise and sequence wise features. We show with broad experiments, that the classical machine learning methods show a superior performance compared to the deep learning methods across a wide range of anomaly types.

Medical Visual Question Answering (Medical-VQA) aims to answer clinical questions regarding radiology images, assisting doctors with decision-making options. Nevertheless, current Medical-VQA models learn cross-modal representations through residing vision and texture encoders in dual separate spaces, which lead to indirect semantic alignment. In this paper, we propose UnICLAM, a Unified and Interpretable Medical-VQA model through Contrastive Representation Learning with Adversarial Masking. Specifically, to learn an aligned image-text representation, we first establish a unified dual-stream pre-training structure with the gradually soft-parameter sharing strategy. Technically, the proposed strategy learns a constraint for the vision and texture encoders to be close in a same space, which is gradually loosened as the higher number of layers. Moreover, for grasping the semantic representation, we extend the unified Adversarial Masking data augmentation strategy to the contrastive representation learning of vision and text in a unified manner, alleviating the meaningless of the commonly used random mask. Concretely, while the encoder training minimizes the distance between the original feature and the masking feature, the adversarial masking model keeps adversarial learning to conversely maximize the distance. Furthermore, we also intuitively take a further exploration of the unified adversarial masking strategy, which improves the potential ante-hoc interpretability with remarkable performance and efficiency. Experimental results on VQA-RAD and SLAKE public benchmarks demonstrate that UnICLAM outperforms the existing 11 state-of-the-art Medical-VQA models. More importantly, we make an additional discussion about the performance of UnICLAM in diagnosing heart failure, verifying that UnICLAM exhibits superior few-shot adaption performance in practical disease diagnosis.

Obtaining ground truth data in medical imaging has difficulties due to the fact that it requires a lot of annotating time from the experts in the field. Also, when trained with supervised learning, it detects only the cases included in the labels. In real practice, we want to also open to other possibilities than the named cases while examining the medical images. As a solution, the need for anomaly detection that can detect and localize abnormalities by learning the normal characteristics using only normal images is emerging. With medical image data, we can design either 2D or 3D networks of self-supervised learning for anomaly detection task. Although 3D networks, which learns 3D structures of the human body, show good performance in 3D medical image anomaly detection, they cannot be stacked in deeper layers due to memory problems. While 2D networks have advantage in feature detection, they lack 3D context information. In this paper, we develop a method for combining the strength of the 3D network and the strength of the 2D network through joint embedding. We also propose the pretask of self-supervised learning to make it possible for the networks to learn efficiently. Through the experiments, we show that the proposed method achieves better performance in both classification and segmentation tasks compared to the SoTA method.

Variational autoencoders and Helmholtz machines use a recognition network (encoder) to approximate the posterior distribution of a generative model (decoder). In this paper we study the necessary and sufficient properties of a recognition network so that it can model the true posterior distribution exactly. These results are derived in the general context of probabilistic graphical modelling / Bayesian networks, for which the network represents a set of conditional independence statements. We derive both global conditions, in terms of d-separation, and local conditions for the recognition network to have the desired qualities. It turns out that for the local conditions the property perfectness (for every node, all parents are joined) plays an important role.  ( 2 min )

Community detection in Social Networks is associated with finding and grouping the most similar nodes inherent in the network. These similar nodes are identified by computing tie strength. Stronger ties indicates higher proximity shared by connected node pairs. This work is motivated by Granovetter's argument that suggests that strong ties lies within densely connected nodes and the theory that community cores in real-world networks are densely connected. In this paper, we have introduced a novel method called \emph{Disjoint Community detection using Cascades (DCC)} which demonstrates the effectiveness of a new local density based tie strength measure on detecting communities. Here, tie strength is utilized to decide the paths followed for propagating information. The idea is to crawl through the tuple information of cascades towards the community core guided by increasing tie strength. Considering the cascade generation step, a novel preferential membership method has been developed to assign community labels to unassigned nodes. The efficacy of $DCC$ has been analyzed based on quality and accuracy on several real-world datasets and baseline community detection algorithms.

Video segmentation consists of a frame-by-frame selection process of meaningful areas related to foreground moving objects. Some applications include traffic monitoring, human tracking, action recognition, efficient video surveillance, and anomaly detection. In these applications, it is not rare to face challenges such as abrupt changes in weather conditions, illumination issues, shadows, subtle dynamic background motions, and also camouflage effects. In this work, we address such shortcomings by proposing a novel deep learning video segmentation approach that incorporates residual information into the foreground detection learning process. The main goal is to provide a method capable of generating an accurate foreground detection given a grayscale video. Experiments conducted on the Change Detection 2014 and on the private dataset PetrobrasROUTES from Petrobras support the effectiveness of the proposed approach concerning some state-of-the-art video segmentation techniques, with overall F-measures of $\mathbf{0.9535}$ and $\mathbf{0.9636}$ in the Change Detection 2014 and PetrobrasROUTES datasets, respectively. Such a result places the proposed technique amongst the top 3 state-of-the-art video segmentation methods, besides comprising approximately seven times less parameters than its top one counterpart.

We introduce camouflaged data poisoning attacks, a new attack vector that arises in the context of machine unlearning and other settings when model retraining may be induced. An adversary first adds a few carefully crafted points to the training dataset such that the impact on the model's predictions is minimal. The adversary subsequently triggers a request to remove a subset of the introduced points at which point the attack is unleashed and the model's predictions are negatively affected. In particular, we consider clean-label targeted attacks (in which the goal is to cause the model to misclassify a specific test point) on datasets including CIFAR-10, Imagenette, and Imagewoof. This attack is realized by constructing camouflage datapoints that mask the effect of a poisoned dataset.

Information on the grass growth over a year is essential for some models simulating the use of this resource to feed animals on pasture or at barn with hay or grass silage. Unfortunately, this information is rarely available. The challenge is to reconstruct grass growth from two sources of information: usual daily climate data (rainfall, radiation, etc.) and cumulative growth over the year. We have to be able to capture the effect of seasonal climatic events which are known to distort the growth curve within the year. In this paper, we formulate this challenge as a problem of disaggregating the cumulative growth into a time series. To address this problem, our method applies time series forecasting using climate information and grass growth from previous time steps. Several alternatives of the method are proposed and compared experimentally using a database generated from a grassland process-based model. The results show that our method can accurately reconstruct the time series, independently of the use of the cumulative growth information.

Transformer-based language models have been shown to be highly effective for several NLP tasks. In this paper, we consider three transformer models, BERT, RoBERTa, and XLNet, in both small and large version, and investigate how faithful their representations are with respect to the semantic content of texts. We formalize a notion of semantic faithfulness, in which the semantic content of a text should causally figure in a model's inferences in question answering. We then test this notion by observing a model's behavior on answering questions about a story after performing two novel semantic interventions -- deletion intervention and negation intervention. While transformer models achieve high performance on standard question answering tasks, we show that they fail to be semantically faithful once we perform these interventions for a significant number of cases (~50% for deletion intervention, and ~20% drop in accuracy for negation intervention). We then propose an intervention-based training regime that can mitigate the undesirable effects for deletion intervention by a significant margin (from ~50% to ~6%). We analyze the inner-workings of the models to better understand the effectiveness of intervention-based training for deletion intervention. But we show that this training does not attenuate other aspects of semantic unfaithfulness such as the models' inability to deal with negation intervention or to capture the predicate-argument structure of texts. We also test InstructGPT, via prompting, for its ability to handle the two interventions and to capture predicate-argument structure. While InstructGPT models do achieve very high performance on predicate-argument structure task, they fail to respond adequately to our deletion and negation interventions.  ( 2 min )

An important class of techniques for resonant anomaly detection in high energy physics builds models that can distinguish between reference and target datasets, where only the latter has appreciable signal. Such techniques, including Classification Without Labels (CWoLa) and Simulation Assisted Likelihood-free Anomaly Detection (SALAD) rely on a single reference dataset. They cannot take advantage of commonly-available multiple datasets and thus cannot fully exploit available information. In this work, we propose generalizations of CWoLa and SALAD for settings where multiple reference datasets are available, building on weak supervision techniques. We demonstrate improved performance in a number of settings with realistic and synthetic data. As an added benefit, our generalizations enable us to provide finite-sample guarantees, improving on existing asymptotic analyses.  ( 2 min )

A computational graph in a deep neural network (DNN) denotes a specific data flow diagram (DFD) composed of many tensors and operators. Existing toolkits for visualizing computational graphs are not applicable when the structure is highly complicated and large-scale (e.g., BERT [1]). To address this problem, we propose leveraging a suite of visual simplification techniques, including a cycle-removing method, a module-based edge-pruning algorithm, and an isomorphic subgraph stacking strategy. We design and implement an interactive visualization system that is suitable for computational graphs with up to 10 thousand elements. Experimental results and usage scenarios demonstrate that our tool reduces 60% elements on average and hence enhances the performance for recognizing and diagnosing DNN models. Our contributions are integrated into an open-source DNN visualization toolkit, namely, MindInsight [2].

We present a framework for the unsupervised learning of neurosymbolic encoders, which are encoders obtained by composing neural networks with symbolic programs from a domain-specific language. Our framework naturally incorporates symbolic expert knowledge into the learning process, which leads to more interpretable and factorized latent representations compared to fully neural encoders. We integrate modern program synthesis techniques with the variational autoencoding (VAE) framework, in order to learn a neurosymbolic encoder in conjunction with a standard decoder. The programmatic descriptions from our encoders can benefit many analysis workflows, such as in behavior modeling where interpreting agent actions and movements is important. We evaluate our method on learning latent representations for real-world trajectory data from animal biology and sports analytics. We show that our approach offers significantly better separation of meaningful categories than standard VAEs and leads to practical gains on downstream analysis tasks, such as for behavior classification.

Lifelong learning aims to create AI systems that continuously and incrementally learn during a lifetime, similar to biological learning. Attempts so far have met problems, including catastrophic forgetting, interference among tasks, and the inability to exploit previous knowledge. While considerable research has focused on learning multiple input distributions, typically in classification, lifelong reinforcement learning (LRL) must also deal with variations in the state and transition distributions, and in the reward functions. Modulating masks, recently developed for classification, are particularly suitable to deal with such a large spectrum of task variations. In this paper, we adapted modulating masks to work with deep LRL, specifically PPO and IMPALA agents. The comparison with LRL baselines in both discrete and continuous RL tasks shows competitive performance. We further investigated the use of a linear combination of previously learned masks to exploit previous knowledge when learning new tasks: not only is learning faster, the algorithm solves tasks that we could not otherwise solve from scratch due to extremely sparse rewards. The results suggest that RL with modulating masks is a promising approach to lifelong learning, to the composition of knowledge to learn increasingly complex tasks, and to knowledge reuse for efficient and faster learning.

Recent work shows that the expressive power of Graph Neural Networks (GNNs) in distinguishing non-isomorphic graphs is exactly the same as that of the Weisfeiler-Lehman (WL) graph test. In particular, they show that the WL test can be simulated by GNNs. However, those simulations involve neural networks for the 'combine' function of size polynomial or even exponential in the number of graph nodes $n$, as well as feature vectors of length linear in $n$. We present an improved simulation of the WL test on GNNs with \emph{exponentially} lower complexity. In particular, the neural network implementing the combine function in each node has only a polylogarithmic number of parameters in $n$, and the feature vectors exchanged by the nodes of GNN consists of only $O(\log n)$ bits. We also give logarithmic lower bounds for the feature vector length and the size of the neural networks, showing the (near)-optimality of our construction.

When comparing approximate Gaussian process (GP) models, it can be helpful to be able to generate data from any GP. If we are interested in how approximate methods perform at scale, we may wish to generate very large synthetic datasets to evaluate them. Na\"{i}vely doing so would cost \(\mathcal{O}(n^3)\) flops and \(\mathcal{O}(n^2)\) memory to generate a size \(n\) sample. We demonstrate how to scale such data generation to large \(n\) whilst still providing guarantees that, with high probability, the sample is indistinguishable from a sample from the desired GP.

This article presents our generative model for rhythm action games together with applications in business operations. Rhythm action games are video games in which the player is challenged to issue commands at the right timings during a music session. The timings are rendered in the chart, which consists of visual symbols, called notes, flying through the screen. We introduce our deep generative model, Gen\'eLive!, which outperforms the state-of-the-art model by taking into account musical structures through beats and temporal scales. Thanks to its favorable performance, Gen\'eLive! was put into operation at KLab Inc., a Japan-based video game developer, and reduced the business cost of chart generation by as much as half. The application target included the phenomenal "Love Live!," which has more than 10 million users across Asia and beyond, and is one of the few rhythm action franchises that has led the online era of the genre. In this article, we evaluate the generative performance of Gen\'eLive! using production datasets at KLab as well as open datasets for reproducibility, while the model continues to operate in their business. Our code and the model, tuned and trained using a supercomputer, are publicly available.

Off-policy learning is more unstable compared to on-policy learning in reinforcement learning (RL). One reason for the instability of off-policy learning is a discrepancy between the target ($\pi$) and behavior (b) policy distributions. The discrepancy between $\pi$ and b distributions can be alleviated by employing a smooth variant of the importance sampling (IS), such as the relative importance sampling (RIS). RIS has parameter $\beta\in[0, 1]$ which controls smoothness. To cope with instability, we present the first relative importance sampling-off-policy actor-critic (RIS-Off-PAC) model-free algorithms in RL. In our method, the network yields a target policy (the actor), a value function (the critic) assessing the current policy ($\pi$) using samples drawn from behavior policy. We use action value generated from the behavior policy in reward function to train our algorithm rather than from the target policy. We also use deep neural networks to train both actor and critic. We evaluated our algorithm on a number of Open AI Gym benchmark problems and demonstrate better or comparable performance to several state-of-the-art RL baselines.

In this paper, we consider the computational complexity of bounding the reachable set of a Linear Time-Invariant (LTI) system controlled by a Rectified Linear Unit (ReLU) Two-Level Lattice (TLL) Neural Network (NN) controller. In particular, we show that for such a system and controller, it is possible to compute the exact one-step reachable set in polynomial time in the size of the TLL NN controller (number of neurons). Additionally, we show that a tight bounding box of the reachable set is computable via two polynomial-time methods: one with polynomial complexity in the size of the TLL and the other with polynomial complexity in the Lipschitz constant of the controller and other problem parameters. Finally, we propose a pragmatic algorithm that adaptively combines the benefits of (semi-)exact reachability and approximate reachability, which we call L-TLLBox. We evaluate L-TLLBox with an empirical comparison to a state-of-the-art NN controller reachability tool. In our experiments, L-TLLBox completed reachability analysis as much as 5000x faster than this tool on the same network/system, while producing reach boxes that were from 0.08 to 1.42 times the area.

To date, most directed acyclic graphs (DAGs) structure learning approaches require data to be stored in a central server. However, due to the consideration of privacy protection, data owners gradually refuse to share their personalized raw data to avoid private information leakage, making this task more troublesome by cutting off the first step. Thus, a puzzle arises: \textit{how do we discover the underlying DAG structure from decentralized data?} In this paper, focusing on the additive noise models (ANMs) assumption of data generation, we take the first step in developing a gradient-based learning framework named FedDAG, which can learn the DAG structure without directly touching the local data and also can naturally handle the data heterogeneity. Our method benefits from a two-level structure of each local model. The first level structure learns the edges and directions of the graph and communicates with the server to get the model information from other clients during the learning procedure, while the second level structure approximates the mechanisms among variables and personally updates on its own data to accommodate the data heterogeneity. Moreover, FedDAG formulates the overall learning task as a continuous optimization problem by taking advantage of an equality acyclicity constraint, which can be solved by gradient descent methods to boost the searching efficiency. Extensive experiments on both synthetic and real-world datasets verify the efficacy of the proposed method.

Consider $n$ points independently sampled from a density $p$ of class $\mathcal{C}^2$ on a smooth compact $d$-dimensional sub-manifold $\mathcal{M}$ of $\mathbb{R}^m$, and consider the generator of a random walk visiting these points according to a transition kernel $K$. We study the almost sure uniform convergence of this operator to the diffusive Laplace-Beltrami operator when $n$ tends to infinity. This work extends known results of the past 15 years. In particular, our result does not require the kernel $K$ to be continuous, which covers the cases of walks exploring $k$NN-random and geometric graphs, and convergence rates are given. The distance between the random walk generator and the limiting operator is separated into several terms: a statistical term, related to the law of large numbers, is treated with concentration tools and an approximation term that we control with tools from differential geometry. The convergence of $k$NN Laplacians is detailed.

We prove that for $c>0$ a sufficiently small universal constant that a random set of $c d^2/\log^4(d)$ independent Gaussian random points in $\mathbb{R}^d$ lie on a common ellipsoid with high probability. This nearly establishes a conjecture of~\cite{SaundersonCPW12}, within logarithmic factors. The latter conjecture has attracted significant attention over the past decade, due to its connections to machine learning and sum-of-squares lower bounds for certain statistical problems.

There is increasing adoption of artificial intelligence in drug discovery. However, existing works use machine learning to mainly utilize the chemical structures of molecules yet ignore the vast textual knowledge available in chemistry. Incorporating textual knowledge enables us to realize new drug design objectives, adapt to text-based instructions, and predict complex biological activities. We present a multi-modal molecule structure-text model, MoleculeSTM, by jointly learning molecule's chemical structures and textual descriptions via a contrastive learning strategy. To train MoleculeSTM, we construct the largest multi-modal dataset to date, namely PubChemSTM, with over 280K chemical structure-text pairs. To demonstrate the effectiveness and utility of MoleculeSTM, we design two challenging zero-shot tasks based on text instructions, including structure-text retrieval and molecule editing. MoleculeSTM possesses two main properties: open vocabulary and compositionality via natural language. In experiments, MoleculeSTM obtains the state-of-the-art generalization ability to novel biochemical concepts across various benchmarks.

A recent explosion of research focuses on developing methods and tools for building fair predictive models. However, most of this work relies on the assumption that the training and testing data are representative of the target population on which the model will be deployed. However, real-world training data often suffer from selection bias and are not representative of the target population for many reasons, including the cost and feasibility of collecting and labeling data, historical discrimination, and individual biases. In this paper, we introduce a new framework for certifying and ensuring the fairness of predictive models trained on biased data. We take inspiration from query answering over incomplete and inconsistent databases to present and formalize the problem of consistent range approximation (CRA) of answers to queries about aggregate information for the target population. We aim to leverage background knowledge about the data collection process, biased data, and limited or no auxiliary data sources to compute a range of answers for aggregate queries over the target population that are consistent with available information. We then develop methods that use CRA of such aggregate queries to build predictive models that are certifiably fair on the target population even when no external information about that population is available during training. We evaluate our methods on real data and demonstrate improvements over state of the art. Significantly, we show that enforcing fairness using our methods can lead to predictive models that are not only fair, but more accurate on the target population.

Random graph models with community structure have been studied extensively in the literature. For both the problems of detecting and recovering community structure, an interesting landscape of statistical and computational phase transitions has emerged. A natural unanswered question is: might it be possible to infer properties of the community structure (for instance, the number and sizes of communities) even in situations where actually finding those communities is believed to be computationally hard? We show the answer is no. In particular, we consider certain hypothesis testing problems between models with different community structures, and we show (in the low-degree polynomial framework) that testing between two options is as hard as finding the communities. In addition, our methods give the first computational lower bounds for testing between two different `planted' distributions, whereas previous results have considered testing between a planted distribution and an i.i.d. `null' distribution.

The purpose of this paper is to explore the use of deep learning for the solution of the nonlinear filtering problem. This is achieved by solving the Zakai equation by a deep splitting method, previously developed for approximate solution of (stochastic) partial differential equations. This is combined with an energy-based model for the approximation of functions by a deep neural network. This results in a computationally fast filter that takes observations as input and that does not require re-training when new observations are received. The method is tested on four examples, two linear in one and twenty dimensions and two nonlinear in one dimension. The method shows promising performance when benchmarked against the Kalman filter and the bootstrap particle filter.

Modern telecom systems are monitored with performance and system logs from multiple application layers and components. Detecting anomalous events from these logs is key to identify security breaches, resource over-utilization, critical/fatal errors, etc. Current supervised log anomaly detection frameworks tend to perform poorly on new types or signatures of anomalies with few or unseen samples in the training data. In this work, we propose a meta-learning-based log anomaly detection framework (LogAnMeta) for detecting anomalies from sequence of log events with few samples. LoganMeta train a hybrid few-shot classifier in an episodic manner. The experimental results demonstrate the efficacy of our proposed method

Predicting sets of outcomes -- instead of unique outcomes -- is a promising solution to uncertainty quantification in statistical learning. Despite a rich literature on constructing prediction sets with statistical guarantees, adapting to unknown covariate shift -- a prevalent issue in practice -- poses a serious unsolved challenge. In this paper, we show that prediction sets with finite-sample coverage guarantee are uninformative and propose a novel flexible distribution-free method, PredSet-1Step, to efficiently construct prediction sets with an asymptotic coverage guarantee under unknown covariate shift. We formally show that our method is \textit{asymptotically probably approximately correct}, having well-calibrated coverage error with high confidence for large samples. We illustrate that it achieves nominal coverage in a number of experiments and a data set concerning HIV risk prediction in a South African cohort study. Our theory hinges on a new bound for the convergence rate of the coverage of Wald confidence intervals based on general asymptotically linear estimators.

This paper analyzes $\ell_1$ regularized linear regression under the challenging scenario of having only adversarially corrupted data for training. We use the primal-dual witness paradigm to provide provable performance guarantees for the support of the estimated regression parameter vector to match the actual parameter. Our theoretical analysis shows the counter-intuitive result that an adversary can influence sample complexity by corrupting the irrelevant features, i.e., those corresponding to zero coefficients of the regression parameter vector, which, consequently, do not affect the dependent variable. As any adversarially robust algorithm has its limitations, our theoretical analysis identifies the regimes under which the learning algorithm and adversary can dominate over each other. It helps us to analyze these fundamental limits and address critical scientific questions of which parameters (like mutual incoherence, the maximum and minimum eigenvalue of the covariance matrix, and the budget of adversarial perturbation) play a role in the high or low probability of success of the LASSO algorithm. Also, the derived sample complexity is logarithmic with respect to the size of the regression parameter vector, and our theoretical claims are validated by empirical analysis on synthetic and real-world datasets.

Variational autoencoders and Helmholtz machines use a recognition network (encoder) to approximate the posterior distribution of a generative model (decoder). In this paper we study the necessary and sufficient properties of a recognition network so that it can model the true posterior distribution exactly. These results are derived in the general context of probabilistic graphical modelling / Bayesian networks, for which the network represents a set of conditional independence statements. We derive both global conditions, in terms of d-separation, and local conditions for the recognition network to have the desired qualities. It turns out that for the local conditions the property perfectness (for every node, all parents are joined) plays an important role.  ( 2 min )

An important class of techniques for resonant anomaly detection in high energy physics builds models that can distinguish between reference and target datasets, where only the latter has appreciable signal. Such techniques, including Classification Without Labels (CWoLa) and Simulation Assisted Likelihood-free Anomaly Detection (SALAD) rely on a single reference dataset. They cannot take advantage of commonly-available multiple datasets and thus cannot fully exploit available information. In this work, we propose generalizations of CWoLa and SALAD for settings where multiple reference datasets are available, building on weak supervision techniques. We demonstrate improved performance in a number of settings with realistic and synthetic data. As an added benefit, our generalizations enable us to provide finite-sample guarantees, improving on existing asymptotic analyses.  ( 2 min )

Deploying graph neural networks (GNNs) on whole-graph classification or regression tasks is known to be challenging: it often requires computing node features that are mindful of both local interactions in their neighbourhood and the global context of the graph structure. GNN architectures that navigate this space need to avoid pathological behaviours, such as bottlenecks and oversquashing, while ideally having linear time and space complexity requirements. In this work, we propose an elegant approach based on propagating information over expander graphs. We leverage an efficient method for constructing expander graphs of a given size, and use this insight to propose the EGP model. We show that EGP is able to address all of the above concerns, while requiring minimal effort to set up, and provide evidence of its empirical utility on relevant graph classification datasets and baselines in the Open Graph Benchmark. Importantly, using expander graphs as a template for message passing necessarily gives rise to negative curvature. While this appears to be counterintuitive in light of recent related work on oversquashing, we theoretically demonstrate that negatively curved edges are likely to be required to obtain scalable message passing without bottlenecks. To the best of our knowledge, this is a previously unstudied result in the context of graph representation learning, and we believe our analysis paves the way to a novel class of scalable methods to counter oversquashing in GNNs.  ( 2 min )

This paper presents a novel technique based on gradient boosting to train the final layers of a neural network (NN). Gradient boosting is an additive expansion algorithm in which a series of models are trained sequentially to approximate a given function. A neural network can also be seen as an additive expansion where the scalar product of the responses of the last hidden layer and its weights provide the final output of the network. Instead of training the network as a whole, the proposed algorithm trains the network sequentially in $T$ steps. First, the bias term of the network is initialized with a constant approximation that minimizes the average loss of the data. Then, at each step, a portion of the network, composed of $J$ neurons, is trained to approximate the pseudo-residuals on the training data computed from the previous iterations. Finally, the $T$ partial models and bias are integrated as a single NN with $T \times J$ neurons in the hidden layer. Extensive experiments in classification and regression tasks, as well as in combination with deep neural networks, are carried out showing a competitive generalization performance with respect to neural networks trained with different standard solvers, such as Adam, L-BFGS, SGD and deep models. Furthermore, we show that the proposed method design permits to switch off a number of hidden units during test (the units that were last trained) without a significant reduction of its generalization ability. This permits the adaptation of the model to different classification speed requirements on the fly.  ( 2 min )

We address the problem of unsupervised domain adaptation when the source domain differs from the target domain because of a shift in the distribution of a latent subgroup. When this subgroup confounds all observed data, neither covariate shift nor label shift assumptions apply. We show that the optimal target predictor can be non-parametrically identified with the help of concept and proxy variables available only in the source domain, and unlabeled data from the target. The identification results are constructive, immediately suggesting an algorithm for estimating the optimal predictor in the target. For continuous observations, when this algorithm becomes impractical, we propose a latent variable model specific to the data generation process at hand. We show how the approach degrades as the size of the shift changes, and verify that it outperforms both covariate and label shift adjustment.  ( 2 min )

We introduce a tunable loss function called $\alpha$-loss, parameterized by $\alpha \in (0,\infty]$, which interpolates between the exponential loss ($\alpha = 1/2$), the log-loss ($\alpha = 1$), and the 0-1 loss ($\alpha = \infty$), for the machine learning setting of classification. Theoretically, we illustrate a fundamental connection between $\alpha$-loss and Arimoto conditional entropy, verify the classification-calibration of $\alpha$-loss in order to demonstrate asymptotic optimality via Rademacher complexity generalization techniques, and build-upon a notion called strictly local quasi-convexity in order to quantitatively characterize the optimization landscape of $\alpha$-loss. Practically, we perform class imbalance, robustness, and classification experiments on benchmark image datasets using convolutional-neural-networks. Our main practical conclusion is that certain tasks may benefit from tuning $\alpha$-loss away from log-loss ($\alpha = 1$), and to this end we provide simple heuristics for the practitioner. In particular, navigating the $\alpha$ hyperparameter can readily provide superior model robustness to label flips ($\alpha > 1$) and sensitivity to imbalanced classes ($\alpha < 1$).  ( 2 min )

I am looking to get ahead of the curve. Right now I'm working toward a career in web development, which is still my goal. But, I really do want to learn more about AI and get involved in this field and join different communities. Things like Chat GPT are so exciting and I know is only the beginning! Being a beginner, what would be some of the first steps I should explore and communities to join? submitted by /u/pistolpeter1111 [link] [comments]  ( 48 min )

Been following the AI art debate a little. AI has always bothered me a little over the years. I've always had two questions: For advocates: 1.) How do you believe humans will find meaning as AI continues to be able to do more and more things that humans once did? Maybe there is some ideal that people will be free to do whatever they want. But I think deriving value from "personal projects" only goes so far. I think humans flourish when we are actually needed as integral parts of a community. Just doing things for ourselves will become an empty pursuit quickly. It's hard for me to see how we don't end up in a world like in Wall-E, except the real life version has a lot more suicides. 2.) What is your ultimate goal/hope with this stuff? To me it has always seemed like a lot of the technology has been motivated by nothing more than, "we just wanted to see if we could do it". Which feels pretty irresponsible. I'm sure I'm off here. But I'm thinking of the IBM computer that beat a chess master. Or the art AI software. What value does that really add except, "Hey bro wouldn't it be so cool if all I had to do was type what kind of picture I wanted, and it would appear on screen?" That is all. submitted by /u/BurntTurkeyLeg1399 [link] [comments]  ( 51 min )

It's able to create perfect symmetry of really complicated shapes submitted by /u/district999 [link] [comments]  ( 47 min )

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PLEASE READ THIS IN A BRITISH ACCENT FOR OPTIMUM FUN Channel 4’s alternative Christmas message will be generated and read by an AI, The message will be delivered by Ameca, one of the world’s most advanced robots. Ameca will speak about the highs and lows of 2022, after the King’s annual Christmas message at 3 pm. Know what's even crazier??? During the address, Ameca will also respond to questions about humans. She is due to say that humankind should be “neither happy nor sad” about the past year and “take it as a learning opportunity, a chance to change the way we think about the world and a reminder to help those in need whenever we can”. END OF BRITISH ACCENT, Hope that was fun I actually really hope Ameca has a British accent, that will just take whatever she has to say from a 7 to a freaking 11 over 10! ​ This is from the AI With Vibes Newsletter, read the full issue here: https://aiwithvibes.beehiiv.com/p/google-issues-code-red-response-rise-chatgpt submitted by /u/Mk_Makanaki [link] [comments]  ( 50 min )

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just a dumb question submitted by /u/slavi13222 [link] [comments]  ( 51 min )

Taking the blood type of this sub and others. Might publish a diagram later idk View Poll submitted by /u/ouaisouais2_2 [link] [comments]  ( 51 min )

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Hello! I am looking for any type of AI image generator that can be downloaded offline so I can generate images with my PC instead of cloud platforms In the perfect world situation I would like to have something that can be also updated to renew and refresh it's sample library Thank you! submitted by /u/Greedy_Environment98 [link] [comments]  ( 48 min )

Hey all, A friend and I are trying to make an animation for a song but have been struggling to find an animator to work with us. What we have is the completed storyboard (2D, drawn on iPad), drawn such that each frame of the storyboard could work as a keyframe. Is there an AI-based tool which would interpolate the frames in between using any 2 keyframes? It's alright if it's paid too but would prefer a free one. Thanks in advance :) submitted by /u/yipra97 [link] [comments]  ( 48 min )

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As an AI researcher, after talking with researchers from other domains, I am just wondering why we need to implement other tons of baselines to compare with our own approach in most cases. Painfully, some of the baselines are not open-sourced or well-organized, or nondetailed. To quantify this, I set a rough timer during one research work. I found more than 60% of the time was put into the implementation of other works. I have no idea whether it is my personal case or not. submitted by /u/Jack_Wang_1107 [link] [comments]  ( 49 min )

For years, teachers have struggled to help every student with their individualized educational needs. This gets, even more, tougher in a class of twenty, thirty, or forty students in which every student has to pass through the same tests, irrespective of the student's personalized needs. That said, the schoolrooms of today have not changed much in the past 50 years. Students sit in a room together and complete the same lessons—typically using the same textbooks—no matter their learning skills or expertise in a particular subject. Some students get left behind. Others are left unchallenged and bored by this one-size-for-all approach. AI could do all this now. AI today is helping teachers in creating a series of smart content programs and intelligent tutoring systems that help students learn in a more customized approach. Students will be able to learn new things in a much better way with advanced tutor apps. Such apps can become education mentors for students and provide engaging learning opportunities.AI can now track the performance of an individual student based on his previous grades, participation, and performances and help a student realize his maximum potential. The rest of this article covers some ways in which AI is making education smarter, cheaper, and more accessible to all: AI as a tutor AI can automate grading AI can provide cognitive insights in classrooms AI can improve the education system Read more... https://owlcation.com/academia/4-Amazing-Benefits-of-Artificial-Intelligence-in-Schools submitted by /u/IcyCartoonist1955 [link] [comments]  ( 51 min )

submitted by /u/Vindaya_ [link] [comments]  ( 48 min )

I read Superintelligence several years ago and cant stop thinking about it with relation to the latest buzz around GPT-3. One passage in particular stands out to me: Chapter 10: “An oracle is a question answering system. It might accept questions as natural language and present its answers as text... building an oracle that has a fully domain general ability to answer natural language questions is an AI-complete problem... If one could do that, one could probably also build an AI that has a decent ability to understand human intentions as well as human words.” When I first read this passage it seemed like a concept that was definitely possible but basically just google and un-interesting. GPT meets this description of a generally intelligent AI almost to the letter. It can even go a step further and be used to generate functioning code with real applications. Generating real code moves GPT from being an “oracle” to being a “genie” by Bostrom’s classification as the AI now has a means to interact with the world. The question I then have for discussion is “have we reached human level general AI?” The current capabilities we have are starting read eerily close to descriptions in Superintelligence. One addition question to think about: “What if GPT is asked to write a program which violates a law or is otherwise harmful?” GPT refuses to answer some questions for ethical reasons. On one hand it feels wrong for an AI to give out code which it can identify as violating a law or is a virus. On the other hand an ethical instinct for real-world code queries sounds ripe for “malignant failure”. Is it ethical to have GPT purposely lie to people it can confidently identify as malicious or report illegal activity to the police? Is it ethical to allow clearly identifiable criminals to not be reported? submitted by /u/LanchestersLaw [link] [comments]  ( 68 min )

submitted by /u/supremogh [link] [comments]  ( 65 min )

Every lunar lander tutorial or example I've found so far uses deep RL. Is classical Q learning such an obviously bad idea that no-one bothers with it? I've had some success recently applying Q learning to lunar lander (converting the continuous observations into discrete values) and am surprised there aren't more tutorials about this approach. Am I missing something? submitted by /u/verbigratia [link] [comments]  ( 68 min )

TL;DR: I found GPU compute to be generally cheap and spot or on-demand instances can be launched on AWS for a few USD / hour up to over 100GB vRAM. So I thought it would make sense to run your own SOTA LLM like Bloomz 176B inference endpoint whenever you need it for a few questions to answer. I thought it would still make more sense than shoving money into a closed walled garden like "not-so-OpenAi" when they make ChatGPT or GPT-4 available for $$$. But I struggle due to lack of tutorials/resources. Therefore, I carefully checked benchmarks, model parameters and sizes as well as training sources for all SOTA LLMs here. Knowing since reading the Chinchilla paper that Model Scaling according to OpenAI was wrong and more params != better quality generation. So I was looking for the best per…  ( 74 min )

Hex Application Since we are heading into the holiday season, I thought it would be interesting to take a look if you could create a model to look at morality with user's Reddit comments. I used Scikit-Learn's Logistic Regression Model for this. I started by downloading around 750 comments from Social Grep's website. They have pulled Reddit comments from different sets of subreddits. I pulled from their datasets for confession-like subreddits, the irl subreddits, and the dataset subreddit. I classified the comments manually by a set rule of morality. Once they were scored, I trained/tested the Logistic model with those comments. For the specific user testing, I used PRAW to pull the most recent 50 comments from the username provided in the Hex Application. I ran the trained model and outputted the probability of each comment being nice and took an average of the probabilities and used that value to determine whether the user was naughty or nice. I use a script to email a CSV with all of the tested comments and the final score to the user. Based on the results that have came through so far, the model is definitely biased towards giving the user a nice decision. I believe that is based on the training data being around 70% nice versus naughty. Does anyone have a way to help the model from being biased like that? Feel free to try the app out and let me know what you think! submitted by /u/Steven_Johnson34 [link] [comments]  ( 71 min )

Hi! I am working on a project where I need side by side image comparison data labeled. The task is to check if the two images are of the same object or not. However, I could not find any human labelling services that offer such task format. Any suggestions? submitted by /u/Dust-Level [link] [comments]  ( 68 min )

I have a data set with three columns and want to predict a numerical value. The data set is divided into groups such that each group is 50 rows. There is a necessary constraint where the sum of the predicted value in each group of 50 rows must equal the value in one column for that group. What model can I use for this, if any? submitted by /u/rapp17 [link] [comments]  ( 71 min )

Hello everyone, I'm currently very curious about the performance of self-supervised traing in small models. Tried, mostof the implementation provided by lightly. my question is, should we use all available data for pretraining. could our model benefit from removing similar images?, if so how would you test it? Finally, sampling for pretraining seems to be overlooked in literature, which seems wrong. I'm feeling like I didn't search for it correctly. so any papers that talk about sampling would be great. submitted by /u/sad_potato00 [link] [comments]  ( 70 min )

I am wondering if you have several networks with similar performance on all your available datasets but with different hyperparameters. What would your criteria be to choose one of the networks? E.g would you choose the one with the highest L2 to increase the generalisation? submitted by /u/Wedrux [link] [comments]  ( 69 min )

Intro & source code: https://github.com/houkensjtu/taichi-hackathon-akinasan The circuit of an ordinary RC toy car is modified so that Jetson Nano can control the movement of the car through GPIO port. Of course, we need to use motor drive controller here, because the upper limit of the output current of Jetson Nano is not enough to drive the car motor directly. The convolution neural network (CNN) is implemented using Taichi programming language. The road data was collected, then classified and labeled, and finally used in the training of CNN models. The pre-trained model is imported into Jetson Nano and the action prediction made for the images captured during driving. Demo: https://reddit.com/link/zshrlv/video/pcm3f6id3f7a1/player submitted by /u/TaichiOfficial [link] [comments]  ( 67 min )

I am working on an NMT model, I'm a newbie at this but so far I have a decent result. I'm translating from a rich language to a low-resource one. If I use something different in my generate function (e.g., I've used greedy method and Beam ) I could ostensibly improve the results. What I wonder is, has anybody worked with these for an NMT project involving agglutinative languages? If so, any recommendations? I'm currently searching for options but I honestly don't find much and know less. submitted by /u/Proxify [link] [comments]  ( 68 min )

I have collected experimental data for various conditions. In order to ensure repeatability, each test is replicated 5 times: which means same input but slightly different output due to experimental variability. If you were to build a machine learning algorithm, would you use all 5 data points for each given test, hoping that your algorithm will learn to converge towards the mean response? Or it is advisable to pre-compute the means and only feed these to the model? ( so that you ensure that one input can only have one output) I can see pros and cons to both approches and would welcome feedback. Thank you. submitted by /u/DreamyPen [link] [comments]  ( 70 min )

Dabbling with machine learning at the moment, wanting to create a stock bot that uses an LSTM ANN. Not expecting this thing to be profitable (to start with anyway), until I at least later add more datasets other than just historical price data, but the idea is that I'll need to work with something that's flexible enough to incorporate expanded data sets in the future to draw statistical correlations off (such as sentiment data, financial earnings, etc). But I also want to work with something that's not super-complex and difficult to use since I'm new to both Python (software dev for 10 yrs though so should be able to pick it up fairly easily) and machine learning. After a bit of research, seems like my best options are either Tensorflow or Pytorch (?). Keras was mentioned, but apparently Tensorflow v2 basically has Keras built in, so it's not needed anymore (?). Can someone with a bit of experience please point me in a good starting direction in terms of what ML software/libs to settle on. Thanks! submitted by /u/Careful-Temporary388 [link] [comments]  ( 68 min )

Built on recent advances in machine learning, the model predicts how well individuals will produce and comprehend sentences.  ( 10 min )

Launched at AWS re:Invent 2021, Amazon SageMaker Ground Truth Plus helps you create high-quality training datasets by removing the undifferentiated heavy lifting associated with building data labeling applications and managing the labeling workforce. All you do is share data along with labeling requirements, and Ground Truth Plus sets up and manages your data labeling workflow […]  ( 9 min )

This holiday season, feast on the bounty of food-themed stories NVIDIA Blog readers gobbled up in 2022. Startups in the retail industry — and particularly in quick-service restaurants — are using NVIDIA AI and robotics technology to make it easier to order food in drive-thrus, find beverages on store shelves and have meals delivered. They’re Read article >  ( 5 min )

In a moment of pure serendipity, Lah Yileh Lee and Xinting Lee, a pair of talented singers who often stream their performances online, found themselves performing in a public square in Taipei when NVIDIA founder and CEO Jensen Huang happened upon them. Huang couldn’t resist joining in, cheering on their serenade as they recorded Lady Read article >  ( 5 min )

Gear up for some festive fun this GFN Thursday with some of the GeForce NOW community’s top picks of games to play during the holidays, as well as a new title joining the GeForce NOW library this week. And, following the recent update that enabled Ubisoft Connect account syncing with GeForce NOW, select Ubisoft+ Multi-Access Read article >  ( 6 min )

Game characters BUT in anime neural network... I created pictures of game characters in a social network that makes anime out of any pictures, look, and if it's not difficult to rate here, well, or on YouTube https://youtu.be/ZDdzG333x9Q submitted by /u/Crazy-Assistant5399 [link] [comments]  ( 52 min )

submitted by /u/Valuable-Panic-7793 [link] [comments]  ( 49 min )

Legendary footballers BUT in anime... I created pictures of legendary footballers in a social network that makes anime out of any pictures, look, and if it's not difficult to rate here, well, or on YouTube https://youtu.be/kqGBQ_0BXc0 submitted by /u/Crazy-Assistant5399 [link] [comments]  ( 48 min )

Here are some posts I’ve written that fall under the general heading of coding theory. Although coding theory can overlap with secret codes, it’s more concerned with things like Morse code, Reed-Solomon codes, and Unicode. Radio related Frequency Shift Keying Morse code numbers and abbreviations How efficient is Morse code? Algebraic coding theory Prefix codes […] Coding theory posts first appeared on John D. Cook.  ( 4 min )

For example, if I consider a robot that has to open a door… I would expect it to be more difficult for an agent to learn directly the torques of the joints instead of learning their positions (and mapping these into the required torques with a PID for controlling the robot). ​ Is there any work that discuss this topic? Can you link me a paper? submitted by /u/riccardogauss [link] [comments]  ( 61 min )

Hi! I would like to (independently) train the agents of a multi-agent environment using some popular single agent RL algorithms, such as PPO. Namely, I would like to train each agent as if it was acting in a single agent MDP and see what happens. Is there a way to directly use the algorithms implemented in stable baselines 3 to train agents in a pettingzoo environmen? submitted by /u/Tabunamok [link] [comments]  ( 57 min )

I use DQN (from stable baselines 3) and have the following problem. If I run training multiple times the performance of the trained models is vastly different in testing even though they are trained with the same hyperparameters and seem to converge to the same episode rewards in training. The environment is custom but deterministic (right now). I split the environment into a training part and a test part. So the agent sees new data during the test phase. Trying to illustrate the situation: - Training model A with hyperparameters P. Train on training data TRAIN: good performance on test data TEST - Training model B with hyperparameters P. Train on training data TRAIN: bad performance on test data TEST - Training model C with hyperparameters P. Train on training data TRAIN: bad performance on test data TEST P, TRAIN, and TEST are the same across all 3 Examples of episode reward plots are here: https://imgur.com/a/wT698qK Do you have any ideas of what I could be doing wrong or what is going on? I am doing RL as a hobby and personal learning project, so you can just assume I missed something obvious. Thank you in advance. submitted by /u/---___---___---___ [link] [comments]  ( 64 min )

Battery energy storage system (BESS) can effec-tively mitigate the uncertainty of variable renewable generation. Degradation is unpreventable and hard to model and predict for batteries such as the most popular Lithium-ion battery (LiB). In this paper, we propose a data driven method to predict the bat-tery degradation per a given scheduled battery operational pro-file. Particularly, a neural network based battery degradation (NNBD) model is proposed to quantify the battery degradation with inputs of major battery degradation factors. When incorpo-rating the proposed NNBD model into microgrid day-ahead scheduling (MDS), we can establish a battery degradation based MDS (BDMDS) model that can consider the equivalent battery degradation cost precisely with the proposed cycle based battery usage processing (CBUP) method for the NNBD model. Since the proposed NNBD model is highly non-linear and non-convex, BDMDS would be very hard to solve. To address this issue, a neural network and optimization decoupled heuristic (NNODH) algorithm is proposed in this paper to effectively solve this neural network embedded optimization problem. Simulation results demonstrate that the proposed NNODH algorithm is able to ob-tain the optimal solution with lowest total cost including normal operation cost and battery degradation cost.

Forecasting and decision-making are generally modeled as two sequential steps with no feedback, following an open-loop approach. In this paper, we present application-driven learning, a new closed-loop framework in which the processes of forecasting and decision-making are merged and co-optimized through a bilevel optimization problem. We present our methodology in a general format and prove that the solution converges to the best estimator in terms of the expected cost of the selected application. Then, we propose two solution methods: an exact method based on the KKT conditions of the second-level problem and a scalable heuristic approach suitable for decomposition methods. The proposed methodology is applied to the relevant problem of defining dynamic reserve requirements and conditional load forecasts, offering an alternative approach to current \emph{ad hoc} procedures implemented in industry practices. We benchmark our methodology with the standard sequential least-squares forecast and dispatch planning process. We apply the proposed methodology to an illustrative system and to a wide range of instances, from dozens of buses to large-scale realistic systems with thousands of buses. Our results show that the proposed methodology is scalable and yields consistently better performance than the standard open-loop approach.

Machine learning methods like neural networks are extremely successful and popular in a variety of applications, however, they come at substantial computational costs, accompanied by high energy demands. In contrast, hardware capabilities are limited and there is evidence that technology scaling is stuttering, therefore, new approaches to meet the performance demands of increasingly complex model architectures are required. As an unsafe optimization, noisy computations are more energy efficient, and given a fixed power budget also more time efficient. However, any kind of unsafe optimization requires counter measures to ensure functionally correct results. This work considers noisy computations in an abstract form, and gears to understand the implications of such noise on the accuracy of neural-network-based classifiers as an exemplary workload. We propose a methodology called "Walking Noise" that allows to assess the robustness of different layers of deep architectures by means of a so-called "midpoint noise level" metric. We then investigate the implications of additive and multiplicative noise for different classification tasks and model architectures, with and without batch normalization. While noisy training significantly increases robustness for both noise types, we observe a clear trend to increase weights and thus increase the signal-to-noise ratio for additive noise injection. For the multiplicative case, we find that some networks, with suitably simple tasks, automatically learn an internal binary representation, hence becoming extremely robust. Overall this work proposes a method to measure the layer-specific robustness and shares first insights on how networks learn to compensate injected noise, and thus, contributes to understand robustness against noisy computations.

Skin cancer is the most common cancer in the existing world constituting one-third of the cancer cases. Benign skin cancers are not fatal, can be cured with proper medication. But it is not the same as the malignant skin cancers. In the case of malignant melanoma, in its peak stage, the maximum life expectancy is less than or equal to 5 years. But, it can be cured if detected in early stages. Though there are numerous clinical procedures, the accuracy of diagnosis falls between 49% to 81% and is time-consuming. So, dermoscopy has been brought into the picture. It helped in increasing the accuracy of diagnosis but could not demolish the error-prone behaviour. A quick and less error-prone solution is needed to diagnose this majorly growing skin cancer. This project deals with the usage of deep learning in skin lesion classification. In this project, an automated model for skin lesion classification using dermoscopic images has been developed with CNN(Convolution Neural Networks) as a training model. Convolution neural networks are known for capturing features of an image. So, they are preferred in analyzing medical images to find the characteristics that drive the model towards success. Techniques like data augmentation for tackling class imbalance, segmentation for focusing on the region of interest and 10-fold cross-validation to make the model robust have been brought into the picture. This project also includes usage of certain preprocessing techniques like brightening the images using piece-wise linear transformation function, grayscale conversion of the image, resize the image. This project throws a set of valuable insights on how the accuracy of the model hikes with the bringing of new input strategies, preprocessing techniques. The best accuracy this model could achieve is 0.886.

We study the problem of best arm identification in a federated learning multi-armed bandit setup with a central server and multiple clients. Each client is associated with a multi-armed bandit in which each arm yields {\em i.i.d.}\ rewards following a Gaussian distribution with an unknown mean and known variance. The set of arms is assumed to be the same at all the clients. We define two notions of best arm -- local and global. The local best arm at a client is the arm with the largest mean among the arms local to the client, whereas the global best arm is the arm with the largest average mean across all the clients. We assume that each client can only observe the rewards from its local arms and thereby estimate its local best arm. The clients communicate with a central server on uplinks that entail a cost of $C\ge0$ units per usage per uplink. The global best arm is estimated at the server. The goal is to identify the local best arms and the global best arm with minimal total cost, defined as the sum of the total number of arm selections at all the clients and the total communication cost, subject to an upper bound on the error probability. We propose a novel algorithm {\sc FedElim} that is based on successive elimination and communicates only in exponential time steps and obtain a high probability instance-dependent upper bound on its total cost. The key takeaway from our paper is that for any $C\geq 0$ and error probabilities sufficiently small, the total number of arm selections (resp.\ the total cost) under {\sc FedElim} is at most~$2$ (resp.~$3$) times the maximum total number of arm selections under its variant that communicates in every time step. Additionally, we show that the latter is optimal in expectation up to a constant factor, thereby demonstrating that communication is almost cost-free in {\sc FedElim}. We numerically validate the efficacy of {\sc FedElim}.

Recent times have witnessed an increasing number of applications of deep neural networks towards solving tasks that require superior cognitive abilities, e.g., playing Go, generating art, question answering (such as ChatGPT), etc. Such a dramatic progress raises the question: how generalizable are neural networks in solving problems that demand broad skills? To answer this question, we propose SMART: a Simple Multimodal Algorithmic Reasoning Task and the associated SMART-101 dataset, for evaluating the abstraction, deduction, and generalization abilities of neural networks in solving visuo-linguistic puzzles designed specifically for children in the 6-8 age group. Our dataset consists of 101 unique puzzles; each puzzle comprises a picture and a question, and their solution needs a mix of several elementary skills, including arithmetic, algebra, and spatial reasoning, among others. To scale our dataset towards training deep neural networks, we programmatically generate entirely new instances for each puzzle while retaining their solution algorithm. To benchmark the performance on the SMART-101 dataset, we propose a vision and language meta-learning model using varied state-of-the-art backbone neural networks. Our experiments reveal that while powerful deep models offer reasonable performances on puzzles that they are trained on, they are not better than random accuracy when analyzed for generalization. We also evaluate the recent ChatGPT large language model on a subset of our dataset and find that while ChatGPT produces convincing reasoning abilities, the answers are often incorrect.

Calculating an Air Quality Index (AQI) typically uses data streams from air quality sensors deployed at fixed locations and the calculation is a real time process. If one or a number of sensors are broken or offline, then the real time AQI value cannot be computed. Estimating AQI values for some point in the future is a predictive process and uses historical AQI values to train and build models. In this work we focus on gap filling in air quality data where the task is to predict the AQI at 1, 5 and 7 days into the future. The scenario is where one or a number of air, weather and traffic sensors are offline and explores prediction accuracy under such situations. The work is part of the MediaEval'2022 Urban Air: Urban Life and Air Pollution task submitted by the DCU-Insight-AQ team and uses multimodal and crossmodal data consisting of AQI, weather and CCTV traffic images for air pollution prediction.

Mathematical reasoning is a fundamental aspect of human intelligence and is applicable in various fields, including science, engineering, finance, and everyday life. The development of artificial intelligence (AI) systems capable of solving math problems and proving theorems has garnered significant interest in the fields of machine learning and natural language processing. For example, mathematics serves as a testbed for aspects of reasoning that are challenging for powerful deep learning models, driving new algorithmic and modeling advances. On the other hand, recent advances in large-scale neural language models have opened up new benchmarks and opportunities to use deep learning for mathematical reasoning. In this survey paper, we review the key tasks, datasets, and methods at the intersection of mathematical reasoning and deep learning over the past decade. We also evaluate existing benchmarks and methods, and discuss future research directions in this domain.

Bayesian optimization (BO), while proved highly effective for many black-box function optimization tasks, requires practitioners to carefully select priors that well model their functions of interest. Rather than specifying by hand, researchers have investigated transfer learning based methods to automatically learn the priors, e.g. multi-task BO (Swersky et al., 2013), few-shot BO (Wistuba and Grabocka, 2021) and HyperBO (Wang et al., 2022). However, those prior learning methods typically assume that the input domains are the same for all tasks, weakening their ability to use observations on functions with different domains or generalize the learned priors to BO on different search spaces. In this work, we present HyperBO+: a pre-training approach for hierarchical Gaussian processes that enables the same prior to work universally for Bayesian optimization on functions with different domains. We propose a two-step pre-training method and analyze its appealing asymptotic properties and benefits to BO both theoretically and empirically. On real-world hyperparameter tuning tasks that involve multiple search spaces, we demonstrate that HyperBO+ is able to generalize to unseen search spaces and achieves lower regrets than competitive baselines.

We present lilGym, a new benchmark for language-conditioned reinforcement learning in visual environments. lilGym is based on 2,661 highly-compositional human-written natural language statements grounded in an interactive visual environment. We introduce a new approach for exact reward computation in every possible world state by annotating all statements with executable Python programs. Each statement is paired with multiple start states and reward functions to form thousands of distinct Markov Decision Processes of varying difficulty. We experiment with lilGym with different models and learning regimes. Our results and analysis show that while existing methods are able to achieve non-trivial performance, lilGym forms a challenging open problem. lilGym is available at https://lil.nlp.cornell.edu/lilgym/.

Pre-trained language models (PLMs) are known to improve the generalization performance of natural language understanding models by leveraging large amounts of data during the pre-training phase. However, the out-of-distribution (OOD) generalization problem remains a challenge in many NLP tasks, limiting the real-world deployment of these methods. This paper presents the first attempt at creating a unified benchmark named GLUE-X for evaluating OOD robustness in NLP models, highlighting the importance of OOD robustness and providing insights on how to measure the robustness of a model and how to improve it. The benchmark includes 13 publicly available datasets for OOD testing, and evaluations are conducted on 8 classic NLP tasks over 19 popularly used PLMs. Our findings confirm the need for improved OOD accuracy in NLP tasks, as significant performance degradation was observed in all settings compared to in-distribution (ID) accuracy.

We explore the use of knowledge distillation (KD) for learning compact and accurate models that enable classification of animal behavior from accelerometry data on wearable devices. To this end, we take a deep and complex convolutional neural network, known as residual neural network (ResNet), as the teacher model. ResNet is specifically designed for multivariate time-series classification. We use ResNet to distill the knowledge of animal behavior classification datasets into soft labels, which consist of the predicted pseudo-probabilities of every class for each datapoint. We then use the soft labels to train our significantly less complex student models, which are based on the gated recurrent unit (GRU) and multilayer perceptron (MLP). The evaluation results using two real-world animal behavior classification datasets show that the classification accuracy of the student GRU-MLP models improves appreciably through KD, approaching that of the teacher ResNet model. To further reduce the computational and memory requirements of performing inference using the student models trained via KD, we utilize dynamic fixed-point quantization (DQ) through an appropriate modification of the computational graph of the considered models. We implement both unquantized and quantized versions of the developed KD-based models on the embedded systems of our purpose-built collar and ear tag devices to classify animal behavior in situ and in real time. Our evaluations corroborate the effectiveness of KD and DQ in improving the accuracy and efficiency of in-situ animal behavior classification.

Physical law learning is the ambiguous attempt at automating the derivation of governing equations with the use of machine learning techniques. The current literature focuses however solely on the development of methods to achieve this goal, and a theoretical foundation is at present missing. This paper shall thus serve as a first step to build a comprehensive theoretical framework for learning physical laws, aiming to provide reliability to according algorithms. One key problem consists in the fact that the governing equations might not be uniquely determined by the given data. We will study this problem in the common situation that a physical law is described by an ordinary or partial differential equation. For various different classes of differential equations, we provide both necessary and sufficient conditions for a function to uniquely determine the differential equation which is governing the phenomenon. We then use our results to devise numerical algorithms to determine whether a function solves a differential equation uniquely. Finally, we provide extensive numerical experiments showing that our algorithms in combination with common approaches for learning physical laws indeed allow to guarantee that a unique governing differential equation is learnt, without assuming any knowledge about the function, thereby ensuring reliability.

In this paper, we develop a new algorithm, Annealed Skewed SGD - AskewSGD - for training deep neural networks (DNNs) with quantized weights. First, we formulate the training of quantized neural networks (QNNs) as a smoothed sequence of interval-constrained optimization problems. Then, we propose a new first-order stochastic method, AskewSGD, to solve each constrained optimization subproblem. Unlike algorithms with active sets and feasible directions, AskewSGD avoids projections or optimization under the entire feasible set and allows iterates that are infeasible. The numerical complexity of AskewSGD is comparable to existing approaches for training QNNs, such as the straight-through gradient estimator used in BinaryConnect, or other state of the art methods (ProxQuant, LUQ). We establish convergence guarantees for AskewSGD (under general assumptions for the objective function). Experimental results show that the AskewSGD algorithm performs better than or on par with state of the art methods in classical benchmarks.

Deep unrolling is an emerging deep learning-based image reconstruction methodology that bridges the gap between model-based and purely deep learning-based image reconstruction methods. Although deep unrolling methods achieve state-of-the-art performance for imaging problems and allow the incorporation of the observation model into the reconstruction process, they do not provide any uncertainty information about the reconstructed image, which severely limits their use in practice, especially for safety-critical imaging applications. In this paper, we propose a learning-based image reconstruction framework that incorporates the observation model into the reconstruction task and that is capable of quantifying epistemic and aleatoric uncertainties, based on deep unrolling and Bayesian neural networks. We demonstrate the uncertainty characterization capability of the proposed framework on magnetic resonance imaging and computed tomography reconstruction problems. We investigate the characteristics of the epistemic and aleatoric uncertainty information provided by the proposed framework to motivate future research on utilizing uncertainty information to develop more accurate, robust, trustworthy, uncertainty-aware, learning-based image reconstruction and analysis methods for imaging problems. We show that the proposed framework can provide uncertainty information while achieving comparable reconstruction performance to state-of-the-art deep unrolling methods.

Following how humans communicate, free-text rationales aim to use natural language to explain neural language model (LM) behavior. However, free-text rationales' unconstrained nature makes them prone to hallucination, so it is important to have metrics for free-text rationale quality. Existing free-text rationale metrics measure how consistent the rationale is with the LM's predicted label, but there is no protocol for assessing such metrics' reliability. Thus, we propose FRAME, a framework for evaluating rationale-label consistency (RLC) metrics for free-text rationales. FRAME is based on three axioms: (1) good metrics should yield highest scores for reference rationales, which maximize RLC by construction; (2) good metrics should be appropriately sensitive to semantic perturbation of rationales; and (3) good metrics should be robust to variation in the LM's task performance. Across three text classification datasets, we show that existing RLC metrics cannot satisfy all three FRAME axioms, since they are implemented via model pretraining which muddles the metric's signal. Then, we introduce a non-pretraining RLC metric that greatly outperforms baselines on (1) and (3), while performing competitively on (2). Finally, we discuss the limitations of using RLC to evaluate free-text rationales.

We introduce Physics Informed Symbolic Networks (PISN) which utilize physics-informed loss to obtain a symbolic solution for a system of Partial Differential Equations (PDE). Given a context-free grammar to describe the language of symbolic expressions, we propose to use weighted sum as continuous approximation for selection of a production rule. We use this approximation to define multilayer symbolic networks. We consider Kovasznay flow (Navier-Stokes) and two-dimensional viscous Burger's equations to illustrate that PISN are able to provide a performance comparable to PINNs across various start-of-the-art advances: multiple outputs and governing equations, domain-decomposition, hypernetworks. Furthermore, we propose Physics-informed Neurosymbolic Networks (PINSN) which employ a multilayer perceptron (MLP) operator to model the residue of symbolic networks. PINSNs are observed to give 2-3 orders of performance gain over standard PINN.

Discovering a meaningful symbolic expression that explains experimental data is a fundamental challenge in many scientific fields. We present a novel, open-source computational framework called Scientist-Machine Equation Detector (SciMed), which integrates scientific discipline wisdom in a scientist-in-the-loop approach, with state-of-the-art symbolic regression (SR) methods. SciMed combines a wrapper selection method, that is based on a genetic algorithm, with automatic machine learning and two levels of SR methods. We test SciMed on five configurations of a settling sphere, with and without aerodynamic non-linear drag force, and with excessive noise in the measurements. We show that SciMed is sufficiently robust to discover the correct physically meaningful symbolic expressions from the data, and demonstrate how the integration of domain knowledge enhances its performance. Our results indicate better performance on these tasks than the state-of-the-art SR software packages, even in cases where no knowledge is integrated. Moreover, we demonstrate how SciMed can alert the user about possible missing features, unlike the majority of current SR systems.

We study the fundamental limits to the expressive power of neural networks. Given two sets $F$, $G$ of real-valued functions, we first prove a general lower bound on how well functions in $F$ can be approximated in $L^p(\mu)$ norm by functions in $G$, for any $p \geq 1$ and any probability measure $\mu$. The lower bound depends on the packing number of $F$, the range of $F$, and the fat-shattering dimension of $G$. We then instantiate this bound to the case where $G$ corresponds to a piecewise-polynomial feed-forward neural network, and describe in details the application to two sets $F$: H{\"o}lder balls and multivariate monotonic functions. Beside matching (known or new) upper bounds up to log factors, our lower bounds shed some light on the similarities or differences between approximation in $L^p$ norm or in sup norm, solving an open question by DeVore et al. (2021). Our proof strategy differs from the sup norm case and uses a key probability result of Mendelson (2002).

Research on remote sensing image classification significantly impacts essential human routine tasks such as urban planning and agriculture. Nowadays, the rapid advance in technology and the availability of many high-quality remote sensing images create a demand for reliable automation methods. The current paper proposes two novel deep learning-based architectures for image classification purposes, i.e., the Discriminant Deep Image Prior Network and the Discriminant Deep Image Prior Network+, which combine Deep Image Prior and Triplet Networks learning strategies. Experiments conducted over three well-known public remote sensing image datasets achieved state-of-the-art results, evidencing the effectiveness of using deep image priors for remote sensing image classification.

Bayesian optimization provides an effective method to optimize expensive-to-evaluate black box functions. It has been widely applied to problems in many fields, including notably in computer science, e.g. in machine learning to optimize hyperparameters of neural networks, and in engineering, e.g. in fluid dynamics to optimize control strategies that maximize drag reduction. This paper empirically studies and compares the performance and the robustness of common Bayesian optimization algorithms on a range of synthetic test functions to provide general guidance on the design of Bayesian optimization algorithms for specific problems. It investigates the choice of acquisition function, the effect of different numbers of training samples, the exact and Monte Carlo based calculation of acquisition functions, and both single-point and multi-point optimization. The test functions considered cover a wide selection of challenges and therefore serve as an ideal test bed to understand the performance of Bayesian optimization to specific challenges, and in general. To illustrate how these findings can be used to inform a Bayesian optimization setup tailored to a specific problem, two simulations in the area of computational fluid dynamics are optimized, giving evidence that suitable solutions can be found in a small number of evaluations of the objective function for complex, real problems. The results of our investigation can similarly be applied to other areas, such as machine learning and physical experiments, where objective functions are expensive to evaluate and their mathematical expressions are unknown.

Denoising diffusion models represent a recent emerging topic in computer vision, demonstrating remarkable results in the area of generative modeling. A diffusion model is a deep generative model that is based on two stages, a forward diffusion stage and a reverse diffusion stage. In the forward diffusion stage, the input data is gradually perturbed over several steps by adding Gaussian noise. In the reverse stage, a model is tasked at recovering the original input data by learning to gradually reverse the diffusion process, step by step. Diffusion models are widely appreciated for the quality and diversity of the generated samples, despite their known computational burdens, i.e. low speeds due to the high number of steps involved during sampling. In this survey, we provide a comprehensive review of articles on denoising diffusion models applied in vision, comprising both theoretical and practical contributions in the field. First, we identify and present three generic diffusion modeling frameworks, which are based on denoising diffusion probabilistic models, noise conditioned score networks, and stochastic differential equations. We further discuss the relations between diffusion models and other deep generative models, including variational auto-encoders, generative adversarial networks, energy-based models, autoregressive models and normalizing flows. Then, we introduce a multi-perspective categorization of diffusion models applied in computer vision. Finally, we illustrate the current limitations of diffusion models and envision some interesting directions for future research.

Bilevel optimization plays an essential role in many machine learning tasks, ranging from hyperparameter optimization to meta-learning. Existing studies on bilevel optimization, however, focus on either centralized or synchronous distributed setting. The centralized bilevel optimization approaches require collecting massive amount of data to a single server, which inevitably incur significant communication expenses and may give rise to data privacy risks. Synchronous distributed bilevel optimization algorithms, on the other hand, often face the straggler problem and will immediately stop working if a few workers fail to respond. As a remedy, we propose Asynchronous Distributed Bilevel Optimization (ADBO) algorithm. The proposed ADBO can tackle bilevel optimization problems with both nonconvex upper-level and lower-level objective functions, and its convergence is theoretically guaranteed. Furthermore, it is revealed through theoretic analysis that the iteration complexity of ADBO to obtain the $\epsilon$-stationary point is upper bounded by $\mathcal{O}(\frac{1}{{{\epsilon ^2}}})$. Thorough empirical studies on public datasets have been conducted to elucidate the effectiveness and efficiency of the proposed ADBO.

We propose Deterministic Sequencing of Exploration and Exploitation (DSEE) algorithm with interleaving exploration and exploitation epochs for model-based RL problems that aim to simultaneously learn the system model, i.e., a Markov decision process (MDP), and the associated optimal policy. During exploration, DSEE explores the environment and updates the estimates for expected reward and transition probabilities. During exploitation, the latest estimates of the expected reward and transition probabilities are used to obtain a robust policy with high probability. We design the lengths of the exploration and exploitation epochs such that the cumulative regret grows as a sub-linear function of time.

Understanding Transformer-based models has attracted significant attention, as they lie at the heart of recent technological advances across machine learning. While most interpretability methods rely on running models over inputs, recent work has shown that a zero-pass approach, where parameters are interpreted directly without a forward/backward pass is feasible for some Transformer parameters, and for two-layer attention networks. In this work, we present a theoretical analysis where all parameters of a trained Transformer are interpreted by projecting them into the embedding space, that is, the space of vocabulary items they operate on. We derive a simple theoretical framework to support our arguments and provide ample evidence for its validity. First, an empirical analysis showing that parameters of both pretrained and fine-tuned models can be interpreted in embedding space. Second, we present two applications of our framework: (a) aligning the parameters of different models that share a vocabulary, and (b) constructing a classifier without training by ``translating'' the parameters of a fine-tuned classifier to parameters of a different model that was only pretrained. Overall, our findings open the door to interpretation methods that, at least in part, abstract away from model specifics and operate in the embedding space only.

We aim to resolve this problem by introducing a comprehensive distributed deep learning (DDL) profiler, which can determine the various execution "stalls" that DDL suffers from while running on a public cloud. We have implemented the profiler by extending prior work to additionally estimate two types of communication stalls - interconnect and network stalls. We train popular DNN models using the profiler to characterize various AWS GPU instances and list their advantages and shortcomings for users to make an informed decision. We observe that the more expensive GPU instances may not be the most performant for all DNN models and AWS may sub-optimally allocate hardware interconnect resources. Specifically, the intra-machine interconnect can introduce communication overheads up to 90% of DNN training time and network-connected instances can suffer from up to 5x slowdown compared to training on a single instance. Further, we model the impact of DNN macroscopic features such as the number of layers and the number of gradients on communication stalls. Finally, we propose a measurement-based recommendation model for users to lower their public cloud monetary costs for DDL, given a time budget.

Self-attention based transformer models have been dominating many computer vision tasks in the past few years. Their superb model qualities heavily depend on the excessively large labeled image datasets. In order to reduce the reliance on large labeled datasets, reconstruction based masked autoencoders are gaining popularity, which learn high quality transferable representations from unlabeled images. For the same purpose, recent weakly supervised image pretraining methods explore language supervision from text captions accompanying the images. In this work, we propose masked image pretraining on language assisted representation, dubbed as MILAN. Instead of predicting raw pixels or low level features, our pretraining objective is to reconstruct the image features with substantial semantic signals that are obtained using caption supervision. Moreover, to accommodate our reconstruction target, we propose a more effective prompting decoder architecture and a semantic aware mask sampling mechanism, which further advance the transfer performance of the pretrained model. Experimental results demonstrate that MILAN delivers higher accuracy than the previous works. When the masked autoencoder is pretrained and finetuned on ImageNet-1K dataset with an input resolution of 224x224, MILAN achieves a top-1 accuracy of 85.4% on ViT-Base, surpassing previous state-of-the-arts by 1%. In the downstream semantic segmentation task, MILAN achieves 52.7 mIoU using ViT-Base on ADE20K dataset, outperforming previous masked pretraining results by 4 points.

Over the last years, supervised learning (SL) has established itself as the state-of-the-art for data-driven turbulence modeling. In the SL paradigm, models are trained based on a dataset, which is typically computed a priori from a high-fidelity solution by applying the respective filter function, which separates the resolved and the unresolved flow scales. For implicitly filtered large eddy simulation (LES), this approach is infeasible, since here, the employed discretization itself acts as an implicit filter function. As a consequence, the exact filter form is generally not known and thus, the corresponding closure terms cannot be computed even if the full solution is available. The reinforcement learning (RL) paradigm can be used to avoid this inconsistency by training not on a previously obtained training dataset, but instead by interacting directly with the dynamical LES environment itself. This allows to incorporate the potentially complex implicit LES filter into the training process by design. In this work, we apply a reinforcement learning framework to find an optimal eddy-viscosity for implicitly filtered large eddy simulations of forced homogeneous isotropic turbulence. For this, we formulate the task of turbulence modeling as an RL task with a policy network based on convolutional neural networks that adapts the eddy-viscosity in LES dynamically in space and time based on the local flow state only. We demonstrate that the trained models can provide long-term stable simulations and that they outperform established analytical models in terms of accuracy. In addition, the models generalize well to other resolutions and discretizations. We thus demonstrate that RL can provide a framework for consistent, accurate and stable turbulence modeling especially for implicitly filtered LES.

A learned system uses machine learning (ML) internally to improve performance. We can expect such systems to be vulnerable to some adversarial-ML attacks. Often, the learned component is shared between mutually-distrusting users or processes, much like microarchitectural resources such as caches, potentially giving rise to highly-realistic attacker models. However, compared to attacks on other ML-based systems, attackers face a level of indirection as they cannot interact directly with the learned model. Additionally, the difference between the attack surface of learned and non-learned versions of the same system is often subtle. These factors obfuscate the de-facto risks that the incorporation of ML carries. We analyze the root causes of potentially-increased attack surface in learned systems and develop a framework for identifying vulnerabilities that stem from the use of ML. We apply our framework to a broad set of learned systems under active development. To empirically validate the many vulnerabilities surfaced by our framework, we choose 3 of them and implement and evaluate exploits against prominent learned-system instances. We show that the use of ML caused leakage of past queries in a database, enabled a poisoning attack that causes exponential memory blowup in an index structure and crashes it in seconds, and enabled index users to snoop on each others' key distributions by timing queries over their own keys. We find that adversarial ML is a universal threat against learned systems, point to open research gaps in our understanding of learned-systems security, and conclude by discussing mitigations, while noting that data leakage is inherent in systems whose learned component is shared between multiple parties.

We present in this paper a family of generalized simultaneous perturbation stochastic approximation (G-SPSA) estimators that estimate the gradient of the objective using noisy function measurements, but where the number of function measurements and the form of the gradient estimator is guided by the desired estimator bias. In particular, estimators with more function measurements are seen to result in lower bias. We provide an analysis of convergence of the generalized SPSA algorithm, and point to possible future directions.

Transfer learning increasingly becomes an important tool in handling data scarcity often encountered in machine learning. In the application of high-throughput thickness as a downstream process of the high-throughput optimization of optoelectronic thin films with autonomous workflows, data scarcity occurs especially for new materials. To achieve high-throughput thickness characterization, we propose a machine learning model called thicknessML that predicts thickness from UV-Vis spectrophotometry input and an overarching transfer learning workflow. We demonstrate the transfer learning workflow from generic source domain of generic band-gapped materials to specific target domain of perovskite materials, where the target domain data only come from limited number (18) of refractive indices from literature. The target domain can be easily extended to other material classes with a few literature data. Defining thickness prediction accuracy to be within-10% deviation, thicknessML achieves 92.2% (with a deviation of 3.6%) accuracy with transfer learning compared to 81.8% (with a deviation of 3.6%) 11.7% without (lower mean and larger standard deviation). Experimental validation on six deposited perovskite films also corroborates the efficacy of the proposed workflow by yielding a 10.5% mean absolute percentage error (MAPE).

Matrix Factorization is one of the most successful recommender system techniques over the past decade. However, the classic probabilistic theory framework for matrix factorization is modeled using normal distributions. To find better probabilistic models, algorithms such as RankMat, ZeroMat and DotMat have been invented in recent years. In this paper, we model the user rating behavior in recommender system as a Poisson process, and design an algorithm that relies on no input data to solve the recommendation problem and the cold start issue at the same time. We prove the superiority of our algorithm in comparison with matrix factorization, random placement, Zipf placement, ZeroMat, DotMat, etc.

Are extralinguistic signals such as image pixels crucial for inducing constituency grammars? While past work has shown substantial gains from multimodal cues, we investigate whether such gains persist in the presence of rich information from large language models (LLMs). We find that our approach, LLM-based C-PCFG (LC-PCFG), outperforms previous multi-modal methods on the task of unsupervised constituency parsing, achieving state-of-the-art performance on a variety of datasets. Moreover, LC-PCFG results in an over 50% reduction in parameter count, and speedups in training time of 1.7x for image-aided models and more than 5x for video-aided models, respectively. These results challenge the notion that extralinguistic signals such as image pixels are needed for unsupervised grammar induction, and point to the need for better text-only baselines in evaluating the need of multi-modality for the task.

Prior work has shown that it is possible to expand pretrained Masked Language Models (MLMs) to new languages by learning a new set of embeddings, while keeping the transformer body frozen. Despite learning a small subset of parameters, this approach is not compute-efficient, as training the new embeddings requires a full forward and backward pass over the entire model. In this work, we propose mini-model adaptation, a compute-efficient alternative that builds a shallow mini-model from a fraction of a large model's parameters. New language-specific embeddings can then be efficiently trained over the mini-model, and plugged into the aligned large model for rapid cross-lingual transfer. We explore two approaches to learn mini-models: MiniJoint, which jointly pretrains the primary model and the mini-model using a single transformer with a secondary MLM head at a middle layer; and MiniPost, where we start from a regular pretrained model and build a mini-model by extracting and freezing a few layers and learning a small number of parameters on top. Experiments on XNLI, MLQA and PAWS-X show that mini-model adaptation matches the performance of the standard approach using up to 2.4x less compute.

One of the crucial issues in federated learning is how to develop efficient optimization algorithms. Most of the current ones require full device participation and/or impose strong assumptions for convergence. Different from the widely-used gradient descent-based algorithms, in this paper, we develop an inexact alternating direction method of multipliers (ADMM), which is both computation- and communication-efficient, capable of combating the stragglers' effect, and convergent under mild conditions. Furthermore, it has a high numerical performance compared with several state-of-the-art algorithms for federated learning.

State-of-the-art 3D semantic segmentation models are trained on the off-the-shelf public benchmarks, but they often face the major challenge when these well-trained models are deployed to a new domain. In this paper, we propose an Active-and-Adaptive Segmentation (ADAS) baseline to enhance the weak cross-domain generalization ability of a well-trained 3D segmentation model, and bridge the point distribution gap between domains. Specifically, before the cross-domain adaptation stage begins, ADAS performs an active sampling operation to select a maximally-informative subset from both source and target domains for effective adaptation, reducing the adaptation difficulty under 3D scenarios. Benefiting from the rise of multi-modal 2D-3D datasets, ADAS utilizes a cross-modal attention-based feature fusion module that can extract a representative pair of image features and point features to achieve a bi-directional image-point feature interaction for better safe adaptation. Experimentally, ADAS is verified to be effective in many cross-domain settings including: 1) Unsupervised Domain Adaptation (UDA), which means that all samples from target domain are unlabeled; 2) Unsupervised Few-shot Domain Adaptation (UFDA) which means that only a few unlabeled samples are available in the unlabeled target domain; 3) Active Domain Adaptation (ADA) which means that the selected target samples by ADAS are manually annotated. Their results demonstrate that ADAS achieves a significant accuracy gain by easily coupling ADAS with self-training methods or off-the-shelf UDA works.

Over the past decade, tremendous progress has been made in Recommender Systems (RecSys) for well-known tasks such as next-item and next-basket prediction. On the other hand, the recently proposed next-period recommendation (NPR) task is not covered as much. Current works about NPR are mostly based around distinct problem formulations, methods, and proprietary datasets, making solutions difficult to reproduce. In this article, we aim to fill the gap in RecSys methods evaluation on the NPR task using publicly available datasets and (1) introduce the TTRS, a large-scale financial transactions dataset suitable for RecSys methods evaluation; (2) benchmark popular RecSys approaches on several datasets for the NPR task. When performing our analysis, we found a strong repetitive consumption pattern in several real-world datasets. With this setup, our results suggest that the repetitive nature of data is still hard to generalize for the evaluated RecSys methods, and novel item prediction performance is still questionable.

Despite recent success in large language model (LLM) reasoning, LLMs still struggle with hierarchical multi-step reasoning like generating complex programs. In these cases, humans often start with a high-level algorithmic design and implement each part gradually. We introduce Parsel, a framework enabling automatic implementation and validation of complex algorithms with code LLMs, based on hierarchical function descriptions in natural language. Parsel can be used across domains requiring hierarchical reasoning, e.g. code synthesis, theorem proving, and robotic planning. We demonstrate Parsel's capabilities by using it to generate complex programs that cannot currently be automatically implemented from one description and backtranslating Python programs in the APPS dataset. Beyond modeling capabilities, Parsel allows problem-solving with high-level algorithmic designs, benefiting both students and professional programmers.

In recent years, graph representation learning has achieved remarkable success while suffering from low-quality data problems. As a mature technology to improve data quality in computer vision, data augmentation has also attracted increasing attention in graph domain. For promoting the development of this emerging research direction, in this survey, we comprehensively review and summarize the existing graph data augmentation (GDAug) techniques. Specifically, we first summarize a variety of feasible taxonomies, and then classify existing GDAug studies based on fine-grained graph elements. Furthermore, for each type of GDAug technique, we formalize the general definition, discuss the technical details, and give schematic illustration. In addition, we also summarize common performance metrics and specific design metrics for constructing a GDAug evaluation system. Finally, we summarize the applications of GDAug from both data and model levels, as well as future directions.

Scene change detection is an image processing problem related to partitioning pixels of a digital image into foreground and background regions. Mostly, visual knowledge-based computer intelligent systems, like traffic monitoring, video surveillance, and anomaly detection, need to use change detection techniques. Amongst the most prominent detection methods, there are the learning-based ones, which besides sharing similar training and testing protocols, differ from each other in terms of their architecture design strategies. Such architecture design directly impacts on the quality of the detection results, and also in the device resources capacity, like memory. In this work, we propose a novel Multiscale Cascade Residual Convolutional Neural Network that integrates multiscale processing strategy through a Residual Processing Module, with a Segmentation Convolutional Neural Network. Experiments conducted on two different datasets support the effectiveness of the proposed approach, achieving average overall $\boldsymbol{F\text{-}measure}$ results of $\boldsymbol{0.9622}$ and $\boldsymbol{0.9664}$ over Change Detection 2014 and PetrobrasROUTES datasets respectively, besides comprising approximately eight times fewer parameters. Such obtained results place the proposed technique amongst the top four state-of-the-art scene change detection methods.

Statistical risk assessments inform consequential decisions such as pretrial release in criminal justice, and loan approvals in consumer finance. Such risk assessments make counterfactual predictions, predicting the likelihood of an outcome under a proposed decision (e.g., what would happen if we approved this loan?). A central challenge, however, is that there may have been unmeasured confounders that jointly affected past decisions and outcomes in the historical data. This paper proposes a tractable mean outcome sensitivity model that bounds the extent to which unmeasured confounders could affect outcomes on average. The mean outcome sensitivity model partially identifies the conditional likelihood of the outcome under the proposed decision, popular predictive performance metrics (e.g., accuracy, calibration, TPR, FPR), and commonly-used predictive disparities. We derive their sharp identified sets, and we then solve three tasks that are essential to deploying statistical risk assessments in high-stakes settings. First, we propose a doubly-robust learning procedure for the bounds on the conditional likelihood of the outcome under the proposed decision. Second, we translate our estimated bounds on the conditional likelihood of the outcome under the proposed decision into a robust, plug-in decision-making policy. Third, we develop doubly-robust estimators of the bounds on the predictive performance of an existing risk assessment.

Foundation models are redefining how AI systems are built. Practitioners now follow a standard procedure to build their machine learning solutions: download a copy of a foundation model, and fine-tune it using some in-house data about the target task of interest. Consequently, the Internet is swarmed by a handful of foundation models fine-tuned on many diverse tasks. Yet, these individual fine-tunings often lack strong generalization and exist in isolation without benefiting from each other. In our opinion, this is a missed opportunity, as these specialized models contain diverse features. Based on this insight, we propose model recycling, a simple strategy that leverages multiple fine-tunings of the same foundation model on diverse auxiliary tasks, and repurposes them as rich and diverse initializations for the target task. Specifically, model recycling fine-tunes in parallel each specialized model on the target task, and then averages the weights of all target fine-tunings into a final model. Empirically, we show that model recycling maximizes model diversity by benefiting from diverse auxiliary tasks, and achieves a new state of the art on the reference DomainBed benchmark for out-of-distribution generalization. Looking forward, model recycling is a contribution to the emerging paradigm of updatable machine learning where, akin to open-source software development, the community collaborates to incrementally and reliably update machine learning models.

State-of-the-art automatic augmentation methods (e.g., AutoAugment and RandAugment) for visual recognition tasks diversify training data using a large set of augmentation operations. The range of magnitudes of many augmentation operations (e.g., brightness and contrast) is continuous. Therefore, to make search computationally tractable, these methods use fixed and manually-defined magnitude ranges for each operation, which may lead to sub-optimal policies. To answer the open question on the importance of magnitude ranges for each augmentation operation, we introduce RangeAugment that allows us to efficiently learn the range of magnitudes for individual as well as composite augmentation operations. RangeAugment uses an auxiliary loss based on image similarity as a measure to control the range of magnitudes of augmentation operations. As a result, RangeAugment has a single scalar parameter for search, image similarity, which we simply optimize via linear search. RangeAugment integrates seamlessly with any model and learns model- and task-specific augmentation policies. With extensive experiments on the ImageNet dataset across different networks, we show that RangeAugment achieves competitive performance to state-of-the-art automatic augmentation methods with 4-5 times fewer augmentation operations. Experimental results on semantic segmentation, object detection, foundation models, and knowledge distillation further shows RangeAugment's effectiveness.

Code generation models have achieved impressive performance. However, they tend to be brittle as slight edits to a prompt could lead to very different generations; these robustness properties, critical for user experience when deployed in real-life applications, are not well understood. Most existing works on robustness in text or code tasks have focused on classification, while robustness in generation tasks is an uncharted area and to date there is no comprehensive benchmark for robustness in code generation. In this paper, we propose ReCode, a comprehensive robustness evaluation benchmark for code generation models. We customize over 30 transformations specifically for code on docstrings, function and variable names, code syntax, and code format. They are carefully designed to be natural in real-life coding practice, preserve the original semantic meaning, and thus provide multifaceted assessments of a model's robustness performance. With human annotators, we verified that over 90% of the perturbed prompts do not alter the semantic meaning of the original prompt. In addition, we define robustness metrics for code generation models considering the worst-case behavior under each type of perturbation, taking advantage of the fact that executing the generated code can serve as objective evaluation. We demonstrate ReCode on SOTA models using HumanEval, MBPP, as well as function completion tasks derived from them. Interesting observations include: better robustness for CodeGen over InCoder and GPT-J; models are most sensitive to syntax perturbations; more challenging robustness evaluation on MBPP over HumanEval.

Cell-free multi-user multiple input multiple output networks are a promising alternative to classical cellular architectures, since they have the potential to provide uniform service quality and high resource utilisation over the entire coverage area of the network. To realise this potential, previous works have developed radio resource management mechanisms using various optimisation engines. In this work, we consider the problem of overall ergodic spectral efficiency maximisation in the context of uplink-downlink data power control in cell-free networks. To solve this problem in large networks, and to address convergence-time limitations, we apply scalable multi-objective Bayesian optimisation. Furthermore, we discuss how an intersection of multi-fidelity emulation and Bayesian optimisation can improve radio resource management in cell-free networks.

Numerous research recently proposed integrating Federated Learning (FL) to address the privacy concerns of using machine learning in privacy-sensitive firms. However, the standards of the available frameworks can no longer sustain the rapid advancement and hinder the integration of FL solutions, which can be prominent in advancing the field. In this paper, we propose ModularFed, a research-focused framework that addresses the complexity of FL implementations and the lack of adaptability and extendability in the available frameworks. We provide a comprehensive architecture that assists FL approaches through well-defined protocols to cover three dominant FL paradigms: adaptable workflow, datasets distribution, and third-party application support. Within this architecture, protocols are blueprints that strictly define the framework's components' design, contribute to its flexibility, and strengthen its infrastructure. Further, our protocols aim to enable modularity in FL, supporting third-party plug-and-play architecture and dynamic simulators coupled with major built-in data distributors in the field. Additionally, the framework support wrapping multiple approaches in a single environment to enable consistent replication of FL issues such as clients' deficiency, data distribution, and network latency, which entails a fair comparison of techniques outlying FL technologies. In our evaluation, we examine the applicability of our framework addressing three major FL domains, including statistical distribution and modular-based approaches for resource monitoring and client selection.

We introduce a new image segmentation task, called Entity Segmentation (ES), which aims to segment all visual entities (objects and stuffs) in an image without predicting their semantic labels. By removing the need of class label prediction, the models trained for such task can focus more on improving segmentation quality. It has many practical applications such as image manipulation and editing where the quality of segmentation masks is crucial but class labels are less important. We conduct the first-ever study to investigate the feasibility of convolutional center-based representation to segment things and stuffs in a unified manner, and show that such representation fits exceptionally well in the context of ES. More specifically, we propose a CondInst-like fully-convolutional architecture with two novel modules specifically designed to exploit the class-agnostic and non-overlapping requirements of ES. Experiments show that the models designed and trained for ES significantly outperforms popular class-specific panoptic segmentation models in terms of segmentation quality. Moreover, an ES model can be easily trained on a combination of multiple datasets without the need to resolve label conflicts in dataset merging, and the model trained for ES on one or more datasets can generalize very well to other test datasets of unseen domains. The code has been released at https://github.com/dvlab-research/Entity/.

The evaluation of abstractive summarization models typically uses test data that is identically distributed as training data. In real-world practice, documents to be summarized may contain input noise caused by text extraction artifacts or data pipeline bugs. The robustness of model performance under distribution shift caused by such noise is relatively under-studied. We present a large empirical study quantifying the sometimes severe loss in performance (up to 12 ROUGE-1 points) from different types of input noise for a range of datasets and model sizes. We then propose a light-weight method for detecting and removing such noise in the input during model inference without requiring any extra training, auxiliary models, or even prior knowledge of the type of noise. Our proposed approach effectively mitigates the loss in performance, recovering a large fraction of the performance drop, sometimes as large as 11 ROUGE-1 points.

Quantum causality is an emerging field of study which has the potential to greatly advance our understanding of quantum systems. In this paper, we put forth a theoretical framework for merging quantum information science and causal inference by exploiting entropic principles. For this purpose, we leverage the tradeoff between the entropy of hidden cause and the conditional mutual information of observed variables to develop a scalable algorithmic approach for inferring causality in the presence of latent confounders (common causes) in quantum systems. As an application, we consider a system of three entangled qubits and transmit the second and third qubits over separate noisy quantum channels. In this model, we validate that the first qubit is a latent confounder and the common cause of the second and third qubits. In contrast, when two entangled qubits are prepared and one of them is sent over a noisy channel, there is no common confounder. We also demonstrate that the proposed approach outperforms the results of classical causal inference for the Tubingen database when the variables are classical by exploiting quantum dependence between variables through density matrices rather than joint probability distributions. Thus, the proposed approach unifies classical and quantum causal inference in a principled way.

The receptive field (RF), which determines the region of time series to be ``seen'' and used, is critical to improve the performance for time series classification (TSC). However, the variation of signal scales across and within time series data, makes it challenging to decide on proper RF sizes for TSC. In this paper, we propose a dynamic sparse network (DSN) with sparse connections for TSC, which can learn to cover various RF without cumbersome hyper-parameters tuning. The kernels in each sparse layer are sparse and can be explored under the constraint regions by dynamic sparse training, which makes it possible to reduce the resource cost. The experimental results show that the proposed DSN model can achieve state-of-art performance on both univariate and multivariate TSC datasets with less than 50\% computational cost compared with recent baseline methods, opening the path towards more accurate resource-aware methods for time series analyses. Our code is publicly available at: https://github.com/QiaoXiao7282/DSN.

We propose Panoptic Lifting, a novel approach for learning panoptic 3D volumetric representations from images of in-the-wild scenes. Once trained, our model can render color images together with 3D-consistent panoptic segmentation from novel viewpoints. Unlike existing approaches which use 3D input directly or indirectly, our method requires only machine-generated 2D panoptic segmentation masks inferred from a pre-trained network. Our core contribution is a panoptic lifting scheme based on a neural field representation that generates a unified and multi-view consistent, 3D panoptic representation of the scene. To account for inconsistencies of 2D instance identifiers across views, we solve a linear assignment with a cost based on the model's current predictions and the machine-generated segmentation masks, thus enabling us to lift 2D instances to 3D in a consistent way. We further propose and ablate contributions that make our method more robust to noisy, machine-generated labels, including test-time augmentations for confidence estimates, segment consistency loss, bounded segmentation fields, and gradient stopping. Experimental results validate our approach on the challenging Hypersim, Replica, and ScanNet datasets, improving by 8.4, 13.8, and 10.6% in scene-level PQ over state of the art.

Compared to conventional bilingual translation systems, massively multilingual machine translation is appealing because a single model can translate into multiple languages and benefit from knowledge transfer for low resource languages. On the other hand, massively multilingual models suffer from the curse of multilinguality, unless scaling their size massively, which increases their training and inference costs. Sparse Mixture-of-Experts models are a way to drastically increase model capacity without the need for a proportional amount of computing. The recently released NLLB-200 is an example of such a model. It covers 202 languages but requires at least four 32GB GPUs just for inference. In this work, we propose a pruning method that allows the removal of up to 80\% of experts with a negligible loss in translation quality, which makes it feasible to run the model on a single 32GB GPU. Further analysis suggests that our pruning metrics allow to identify language-specific experts and prune non-relevant experts for a given language pair.

Task transfer learning is a popular technique in image processing applications that uses pre-trained models to reduce the supervision cost of related tasks. An important question is to determine task transferability, i.e. given a common input domain, estimating to what extent representations learned from a source task can help in learning a target task. Typically, transferability is either measured experimentally or inferred through task relatedness, which is often defined without a clear operational meaning. In this paper, we present a novel metric, H-score, an easily-computable evaluation function that estimates the performance of transferred representations from one task to another in classification problems using statistical and information theoretic principles. Experiments on real image data show that our metric is not only consistent with the empirical transferability measurement, but also useful to practitioners in applications such as source model selection and task transfer curriculum learning.

Search and Rescue (SAR) missions in remote environments often employ autonomous multi-robot systems that learn, plan, and execute a combination of local single-robot control actions, group primitives, and global mission-oriented coordination and collaboration. Often, SAR coordination strategies are manually designed by human experts who can remotely control the multi-robot system and enable semi-autonomous operations. However, in remote environments where connectivity is limited and human intervention is often not possible, decentralized collaboration strategies are needed for fully-autonomous operations. Nevertheless, decentralized coordination may be ineffective in adversarial environments due to sensor noise, actuation faults, or manipulation of inter-agent communication data. In this paper, we propose an algorithmic approach based on adversarial multi-agent reinforcement learning (MARL) that allows robots to efficiently coordinate their strategies in the presence of adversarial inter-agent communications. In our setup, the objective of the multi-robot team is to discover targets strategically in an obstacle-strewn geographical area by minimizing the average time needed to find the targets. It is assumed that the robots have no prior knowledge of the target locations, and they can interact with only a subset of neighboring robots at any time. Based on the centralized training with decentralized execution (CTDE) paradigm in MARL, we utilize a hierarchical meta-learning framework to learn dynamic team-coordination modalities and discover emergent team behavior under complex cooperative-competitive scenarios. The effectiveness of our approach is demonstrated on a collection of prototype grid-world environments with different specifications of benign and adversarial agents, target locations, and agent rewards.

Wearable sensors for measuring head kinematics can be noisy due to imperfect interfaces with the body. Mouthguards are used to measure head kinematics during impacts in traumatic brain injury (TBI) studies, but deviations from reference kinematics can still occur due to potential looseness. In this study, deep learning is used to compensate for the imperfect interface and improve measurement accuracy. A set of one-dimensional convolutional neural network (1D-CNN) models was developed to denoise mouthguard kinematics measurements along three spatial axes of linear acceleration and angular velocity. The denoised kinematics had significantly reduced errors compared to reference kinematics, and reduced errors in brain injury criteria and tissue strain and strain rate calculated via finite element modeling. The 1D-CNN models were also tested on an on-field dataset of college football impacts and a post-mortem human subject dataset, with similar denoising effects observed. The models can be used to improve detection of head impacts and TBI risk evaluation, and potentially extended to other sensors measuring kinematics.

Gaussian processes scale prohibitively with the size of the dataset. In response, many approximation methods have been developed, which inevitably introduce approximation error. This additional source of uncertainty, due to limited computation, is entirely ignored when using the approximate posterior. Therefore in practice, GP models are often as much about the approximation method as they are about the data. Here, we develop a new class of methods that provides consistent estimation of the combined uncertainty arising from both the finite number of data observed and the finite amount of computation expended. The most common GP approximations map to an instance in this class, such as methods based on the Cholesky factorization, conjugate gradients, and inducing points. For any method in this class, we prove (i) convergence of its posterior mean in the associated RKHS, (ii) decomposability of its combined posterior covariance into mathematical and computational covariances, and (iii) that the combined variance is a tight worst-case bound for the squared error between the method's posterior mean and the latent function. Finally, we empirically demonstrate the consequences of ignoring computational uncertainty and show how implicitly modeling it improves generalization performance on benchmark datasets.  ( 2 min )

We study the linear contextual bandit problem where an agent has to select one candidate from a pool and each candidate belongs to a sensitive group. In this setting, candidates' rewards may not be directly comparable between groups, for example when the agent is an employer hiring candidates from different ethnic groups and some groups have a lower reward due to discriminatory bias and/or social injustice. We propose a notion of fairness that states that the agent's policy is fair when it selects a candidate with highest relative rank, which measures how good the reward is when compared to candidates from the same group. This is a very strong notion of fairness, since the relative rank is not directly observed by the agent and depends on the underlying reward model and on the distribution of rewards. Thus we study the problem of learning a policy which approximates a fair policy under the condition that the contexts are independent between groups and the distribution of rewards of each group is absolutely continuous. In particular, we design a greedy policy which at each round constructs a ridge regression estimate from the observed context-reward pairs, and then computes an estimate of the relative rank of each candidate using the empirical cumulative distribution function. We prove that, despite its simplicity and the lack of an initial exploration phase, the greedy policy achieves, up to log factors and with high probability, a fair pseudo-regret of order $\sqrt{dT}$ after $T$ rounds, where $d$ is the dimension of the context vectors. The policy also satisfies demographic parity at each round when averaged over all possible information available before the selection. Finally, we use simulated settings and experiments on the US census data to show that our policy achieves sub-linear fair pseudo-regret also in practice.  ( 3 min )

Deep neural networks (DNNs) are sensitive and susceptible to tiny perturbation by adversarial attacks which causes erroneous predictions. Various methods, including adversarial defense and uncertainty inference (UI), have been developed in recent years to overcome the adversarial attacks. In this paper, we propose a multi-head uncertainty inference (MH-UI) framework for detecting adversarial attack examples. We adopt a multi-head architecture with multiple prediction heads (i.e., classifiers) to obtain predictions from different depths in the DNNs and introduce shallow information for the UI. Using independent heads at different depths, the normalized predictions are assumed to follow the same Dirichlet distribution, and we estimate distribution parameter of it by moment matching. Cognitive uncertainty brought by the adversarial attacks will be reflected and amplified on the distribution. Experimental results show that the proposed MH-UI framework can outperform all the referred UI methods in the adversarial attack detection task with different settings.  ( 2 min )

With increasing privacy concerns on data, recent studies have made significant progress using federated learning (FL) on privacy-sensitive natural language processing (NLP) tasks. Much literature suggests fully fine-tuning pre-trained language models (PLMs) in the FL paradigm can mitigate the data heterogeneity problem and close the performance gap with centralized training. However, large PLMs bring the curse of prohibitive communication overhead and local model adaptation costs for the FL system. To this end, we introduce various parameter-efficient tuning (PETuning) methods into federated learning. Specifically, we provide a holistic empirical study of representative PLMs tuning methods in FL. The experimental results cover the analysis of data heterogeneity levels, data scales, and different FL scenarios. Overall communication overhead can be significantly reduced by locally tuning and globally aggregating lightweight model parameters while maintaining acceptable performance in various FL settings. To facilitate the research of PETuning in FL, we also develop a federated tuning framework FedPETuning, which allows practitioners to exploit different PETuning methods under the FL training paradigm conveniently. The source code is available at \url{https://github.com/iezhuozhuo/FedETuning/tree/deltaTuning}.  ( 2 min )

Factorization machines (FMs) are a powerful tool for regression and classification in the context of sparse observations, that has been successfully applied to collaborative filtering, especially when side information over users or items is available. Bayesian formulations of FMs have been proposed to provide confidence intervals over the predictions made by the model, however they usually involve Markov-chain Monte Carlo methods that require many samples to provide accurate predictions, resulting in slow training in the context of large-scale data. In this paper, we propose a variational formulation of factorization machines that allows us to derive a simple objective that can be easily optimized using standard mini-batch stochastic gradient descent, making it amenable to large-scale data. Our algorithm learns an approximate posterior distribution over the user and item parameters, which leads to confidence intervals over the predictions. We show, using several datasets, that it has comparable or better performance than existing methods in terms of prediction accuracy, and provide some applications in active learning strategies, e.g., preference elicitation techniques.  ( 2 min )

Target Propagation (TP) is a biologically more plausible algorithm than the error backpropagation (BP) to train deep networks, and improving practicality of TP is an open issue. TP methods require the feedforward and feedback networks to form layer-wise autoencoders for propagating the target values generated at the output layer. However, this causes certain drawbacks; e.g., careful hyperparameter tuning is required to synchronize the feedforward and feedback training, and frequent updates of the feedback path are usually required than that of the feedforward path. Learning of the feedforward and feedback networks is sufficient to make TP methods capable of training, but is having these layer-wise autoencoders a necessary condition for TP to work? We answer this question by presenting Fixed-Weight Difference Target Propagation (FW-DTP) that keeps the feedback weights constant during training. We confirmed that this simple method, which naturally resolves the abovementioned problems of TP, can still deliver informative target values to hidden layers for a given task; indeed, FW-DTP consistently achieves higher test performance than a baseline, the Difference Target Propagation (DTP), on four classification datasets. We also present a novel propagation architecture that explains the exact form of the feedback function of DTP to analyze FW-DTP.

We propose a new approach to learning the subgrid-scale model effects when simulating partial differential equations (PDEs) solved by the method of lines and their representation in chaotic ordinary differential equations, based on neural ordinary differential equations (NODEs). Solving systems with fine temporal and spatial grid scales is an ongoing computational challenge, and closure models are generally difficult to tune. Machine learning approaches have increased the accuracy and efficiency of computational fluid dynamics solvers. In this approach neural networks are used to learn the coarse- to fine-grid map, which can be viewed as subgrid scale parameterization. We propose a strategy that uses the NODE and partial knowledge to learn the source dynamics at a continuous level. Our method inherits the advantages of NODEs and can be used to parameterize subgrid scales, approximate coupling operators, and improve the efficiency of low-order solvers. Numerical results using the two-scale Lorenz 96 ODE and the convection-diffusion PDE are used to illustrate this approach.

Deep learning (DL) is gaining popularity as a parameter estimation method for quantitative MRI. A range of competing implementations have been proposed, relying on either supervised or self-supervised learning. Self-supervised approaches, sometimes referred to as unsupervised, have been loosely based on auto-encoders, whereas supervised methods have, to date, been trained on groundtruth labels. These two learning paradigms have been shown to have distinct strengths. Notably, self-supervised approaches have offered lower-bias parameter estimates than their supervised alternatives. This result is counterintuitive - incorporating prior knowledge with supervised labels should, in theory, lead to improved accuracy. In this work, we show that this apparent limitation of supervised approaches stems from the naive choice of groundtruth training labels. By training on labels which are deliberately not groundtruth, we show that the low-bias parameter estimation previously associated with self-supervised methods can be replicated - and improved on - within a supervised learning framework. This approach sets the stage for a single, unifying, deep learning parameter estimation framework, based on supervised learning, where trade-offs between bias and variance are made by careful adjustment of training label.  ( 2 min )

In this paper, we investigate the degree of explainability of graph neural networks (GNNs). Existing explainers work by finding global/local subgraphs to explain a prediction, but they are applied after a GNN has already been trained. Here, we propose a meta-learning framework for improving the level of explainability of a GNN directly at training time, by steering the optimization procedure towards what we call `interpretable minima'. Our framework (called MATE, MetA-Train to Explain) jointly trains a model to solve the original task, e.g., node classification, and to provide easily processable outputs for downstream algorithms that explain the model's decisions in a human-friendly way. In particular, we meta-train the model's parameters to quickly minimize the error of an instance-level GNNExplainer trained on-the-fly on randomly sampled nodes. The final internal representation relies upon a set of features that can be `better' understood by an explanation algorithm, e.g., another instance of GNNExplainer. Our model-agnostic approach can improve the explanations produced for different GNN architectures and use any instance-based explainer to drive this process. Experiments on synthetic and real-world datasets for node and graph classification show that we can produce models that are consistently easier to explain by different algorithms. Furthermore, this increase in explainability comes at no cost for the accuracy of the model.  ( 2 min )

Contrastive Language-Image Pre-training (CLIP) has demonstrated great potential in realizing open-vocabulary visual recognition in a matching style, due to its holistic use of natural language supervision that covers unconstrained real-world visual concepts. However, it is, in turn, also difficult to evaluate and analyze the openness of CLIP-like models, since they are in theory open to any vocabulary but the actual accuracy varies. To address the insufficiency of conventional studies on openness, we resort to an incremental perspective and define the extensibility, which essentially approximates the model's ability to deal with new visual concepts, by evaluating openness through vocabulary expansions. Our evaluation based on extensibility shows that CLIP-like models are hardly truly open and their performance degrades as the vocabulary expands to different degrees. Further analysis reveals that the over-estimation of openness is not because CLIP-like models fail to capture the general similarity of image and text features of novel visual concepts, but because of the confusion among competing text features, that is, they are not stable with respect to the vocabulary. In light of this, we propose to improve the openness of CLIP in the feature space by enforcing the distinguishability of text features. Our method retrieves relevant texts from the pre-training corpus to enhance prompts for inference, which boosts the extensibility and stability of CLIP even without fine-tuning.  ( 2 min )

In the Priority $k$-Center problem, the input consists of a metric space $(X,d)$, an integer $k$, and for each point $v \in X$ a priority radius $r(v)$. The goal is to choose $k$-centers $S \subseteq X$ to minimize $\max_{v \in X} \frac{1}{r(v)} d(v,S)$. If all $r(v)$'s are uniform, one obtains the $k$-Center problem. Plesn\'ik [Plesn\'ik, Disc. Appl. Math. 1987] introduced the Priority $k$-Center problem and gave a $2$-approximation algorithm matching the best possible algorithm for $k$-Center. We show how the problem is related to two different notions of fair clustering [Harris et al., NeurIPS 2018; Jung et al., FORC 2020]. Motivated by these developments we revisit the problem and, in our main technical contribution, develop a framework that yields constant factor approximation algorithms for Priority $k$-Center with outliers. Our framework extends to generalizations of Priority $k$-Center to matroid and knapsack constraints, and as a corollary, also yields algorithms with fairness guarantees in the lottery model of Harris et al [Harris et al, JMLR 2019].  ( 2 min )

We consider the problem of dynamic pricing of a product in the presence of feature-dependent price sensitivity. Developing practical algorithms that can estimate price elasticities robustly, especially when information about no purchases (losses) is not available, to drive such automated pricing systems is a challenge faced by many industries. Based on the Poisson semi-parametric approach, we construct a flexible yet interpretable demand model where the price related part is parametric while the remaining (nuisance) part of the model is non-parametric and can be modeled via sophisticated machine learning (ML) techniques. The estimation of price-sensitivity parameters of this model via direct one-stage regression techniques may lead to biased estimates due to regularization. To address this concern, we propose a two-stage estimation methodology which makes the estimation of the price-sensitivity parameters robust to biases in the estimators of the nuisance parameters of the model. In the first-stage we construct estimators of observed purchases and prices given the feature vector using sophisticated ML estimators such as deep neural networks. Utilizing the estimators from the first-stage, in the second-stage we leverage a Bayesian dynamic generalized linear model to estimate the price-sensitivity parameters. We test the performance of the proposed estimation schemes on simulated and real sales transaction data from the Airline industry. Our numerical studies demonstrate that our proposed two-stage approach reduces the estimation error in price-sensitivity parameters from 25\% to 4\% in realistic simulation settings. The two-stage estimation techniques proposed in this work allows practitioners to leverage modern ML techniques to robustly estimate price-sensitivities while still maintaining interpretability and allowing ease of validation of its various constituent parts.  ( 3 min )

Recently, many causal estimators for Conditional Average Treatment Effect (CATE) and instrumental variable (IV) problems have been published and open sourced, allowing to estimate granular impact of both randomized treatments (such as A/B tests) and of user choices on the outcomes of interest. However, the practical application of such models has ben hampered by the lack of a valid way to score the performance of such models out of sample, in order to select the best one for a given application. We address that gap by proposing novel scoring approaches for both the CATE case and an important subset of instrumental variable problems, namely those where the instrumental variable is customer acces to a product feature, and the treatment is the customer's choice to use that feature. Being able to score model performance out of sample allows us to apply hyperparameter optimization methods to causal model selection and tuning. We implement that in an open source package that relies on DoWhy and EconML libraries for implementation of causal inference models (and also includes a Transformed Outcome model implementation), and on FLAML for hyperparameter optimization and for component models used in the causal models. We demonstrate on synthetic data that optimizing the proposed scores is a reliable method for choosing the model and its hyperparameter values, whose estimates are close to the true impact, in the randomized CATE and IV cases. Further, we provide examles of applying these methods to real customer data from Wise.  ( 2 min )

Past work has shown that large language models are susceptible to privacy attacks, where adversaries generate sequences from a trained model and detect which sequences are memorized from the training set. In this work, we show that the success of these attacks is largely due to duplication in commonly used web-scraped training sets. We first show that the rate at which language models regenerate training sequences is superlinearly related to a sequence's count in the training set. For instance, a sequence that is present 10 times in the training data is on average generated ~1000 times more often than a sequence that is present only once. We next show that existing methods for detecting memorized sequences have near-chance accuracy on non-duplicated training sequences. Finally, we find that after applying methods to deduplicate training data, language models are considerably more secure against these types of privacy attacks. Taken together, our results motivate an increased focus on deduplication in privacy-sensitive applications and a reevaluation of the practicality of existing privacy attacks.  ( 2 min )

Object-centric representation is an essential abstraction for forward prediction. Most existing forward models learn this representation through extensive supervision (e.g., object class and bounding box) although such ground-truth information is not readily accessible in reality. To address this, we introduce KINet (Keypoint Interaction Network) -- an end-to-end unsupervised framework to reason about object interactions based on a keypoint representation. Using visual observations, our model learns to associate objects with keypoint coordinates and discovers a graph representation of the system as a set of keypoint embeddings and their relations. It then learns an action-conditioned forward model using contrastive estimation to predict future keypoint states. By learning to perform physical reasoning in the keypoint space, our model automatically generalizes to scenarios with a different number of objects, novel backgrounds, and unseen object geometries. Experiments demonstrate the effectiveness of our model in accurately performing forward prediction and learning plannable object-centric representations which can also be used in downstream robotic manipulation tasks.

We apply the vision transformer, a deep machine learning model build around the attention mechanism, on mel-spectrogram representations of raw audio recordings. When adding mel-based data augmentation techniques and sample-weighting, we achieve comparable performance on both (PRS and CCS challenge) tasks of ComParE21, outperforming most single model baselines. We further introduce overlapping vertical patching and evaluate the influence of parameter configurations. Index Terms: audio classification, attention, mel-spectrogram, unbalanced data-sets, computational paralinguistics

A computational framework that leverages data from self-consistent field theory simulations with deep learning to accelerate the exploration of parameter space for block copolymers is presented. This is a substantial two-dimensional extension of the framework introduced in [1]. Several innovations and improvements are proposed. (1) A Sobolev space-trained, convolutional neural network (CNN) is employed to handle the exponential dimension increase of the discretized, local average monomer density fields and to strongly enforce both spatial translation and rotation invariance of the predicted, field-theoretic intensive Hamiltonian. (2) A generative adversarial network (GAN) is introduced to efficiently and accurately predict saddle point, local average monomer density fields without resorting to gradient descent methods that employ the training set. This GAN approach yields important savings of both memory and computational cost. (3) The proposed machine learning framework is successfully applied to 2D cell size optimization as a clear illustration of its broad potential to accelerate the exploration of parameter space for discovering polymer nanostructures. Extensions to three-dimensional phase discovery appear to be feasible.

There is significant interest in deploying machine learning algorithms for diagnostic radiology, as modern learning techniques have made it possible to detect abnormalities in medical images within minutes. While machine-assisted diagnoses cannot yet reliably replace human reviews of images by a radiologist, they could inform prioritization rules for determining the order by which to review patient cases so that patients with time-sensitive conditions could benefit from early intervention. We study this scenario by formulating it as a learning-augmented online scheduling problem. We are given information about each arriving patient's urgency level in advance, but these predictions are inevitably error-prone. In this formulation, we face the challenges of decision making under imperfect information, and of responding dynamically to prediction error as we observe better data in real-time. We propose a simple online policy and show that this policy is in fact the best possible in certain stylized settings. We also demonstrate that our policy achieves the two desiderata of online algorithms with predictions: consistency (performance improvement with prediction accuracy) and robustness (protection against the worst case). We complement our theoretical findings with empirical evaluations of the policy under settings that more accurately reflect clinical scenarios in the real world.

The ever-growing deep learning technologies are making revolutionary changes for modern life. However, conventional computing architectures are designed to process sequential and digital programs, being extremely burdened with performing massive parallel and adaptive deep learning applications. Photonic integrated circuits provide an efficient approach to mitigate bandwidth limitations and power-wall brought by its electronic counterparts, showing great potential in ultrafast and energy-free high-performance computing. Here, we propose an optical computing architecture enabled by on-chip diffraction to implement convolutional acceleration, termed optical convolution unit (OCU). We demonstrate that any real-valued convolution kernels can be exploited by OCU with a prominent computational throughput boosting via the concept of structral re-parameterization. With OCU as the fundamental unit, we build an optical convolutional neural network (oCNN) to implement two popular deep learning tasks: classification and regression. For classification, Fashion-MNIST and CIFAR-4 datasets are tested with accuracy of 91.63% and 86.25%, respectively. For regression, we build an optical denoising convolutional neural network (oDnCNN) to handle Gaussian noise in gray scale images with noise level {\sigma} = 10, 15, 20, resulting clean images with average PSNR of 31.70dB, 29.39dB and 27.72dB, respectively. The proposed OCU presents remarkable performance of low energy consumption and high information density due to its fully passive nature and compact footprint, providing a highly parallel while lightweight solution for future computing architecture to handle high dimensional tensors in deep learning.

In this study, we propose a novel adversarial reprogramming (AR) approach for low-resource spoken command recognition (SCR), and build an AR-SCR system. The AR procedure aims to modify the acoustic signals (from the target domain) to repurpose a pretrained SCR model (from the source domain). To solve the label mismatches between source and target domains, and further improve the stability of AR, we propose a novel similarity-based label mapping technique to align classes. In addition, the transfer learning (TL) technique is combined with the original AR process to improve the model adaptation capability. We evaluate the proposed AR-SCR system on three low-resource SCR datasets, including Arabic, Lithuanian, and dysarthric Mandarin speech. Experimental results show that with a pretrained AM trained on a large-scale English dataset, the proposed AR-SCR system outperforms the current state-of-the-art results on Arabic and Lithuanian speech commands datasets, with only a limited amount of training data.

Language models (LMs) have demonstrated remarkable performance on downstream tasks, using in-context exemplars or human instructions. Recent works have shown that chain-of-thought (CoT) prompting can elicit models to solve complex reasoning tasks, step-by-step. However, the efficacy of prompt-based CoT methods is restricted to very large LMs such as GPT-3 (175B), thus limiting deployability. In this paper, we revisit the fine-tuning approach to enable complex reasoning in smaller LMs, optimized to efficiently perform a specific task. We propose Fine-tune-CoT, a method that leverages the capabilities of very large LMs to generate reasoning samples and teach smaller models via fine-tuning. We evaluate our method on publicly available LMs across a wide range of complex tasks and model sizes. We find that Fine-tune-CoT enables substantial reasoning capability in small models, whereas previous prompt-based baselines exhibit near-random performance. Student models can even outperform the teacher in some tasks while reducing model size requirements by several orders of magnitude. We conduct extensive ablations and sample studies to understand the reasoning capabilities of student models. We also identify several important nuances that have been overlooked in concurrent fine-tuning works on CoT and address them in our analysis.

Existing neural network verifiers compute a proof that each input is handled correctly under a given perturbation by propagating a symbolic abstraction of reachable values at each layer. This process is repeated from scratch independently for each input (e.g., image) and perturbation (e.g., rotation), leading to an expensive overall proof effort when handling an entire dataset. In this work, we introduce a new method for reducing this verification cost without losing precision based on a key insight that abstractions obtained at intermediate layers for different inputs and perturbations can overlap or contain each other. Leveraging our insight, we introduce the general concept of shared certificates, enabling proof effort reuse across multiple inputs to reduce overall verification costs. We perform an extensive experimental evaluation to demonstrate the effectiveness of shared certificates in reducing the verification cost on a range of datasets and attack specifications on image classifiers including the popular patch and geometric perturbations. We release our implementation at https://github.com/eth-sri/proof-sharing.

Modelling interactions is critical in learning complex dynamical systems, namely systems of interacting objects with highly non-linear and time-dependent behaviour. A large class of such systems can be formalized as $\textit{geometric graphs}$, $\textit{i.e.}$, graphs with nodes positioned in the Euclidean space given an $\textit{arbitrarily}$ chosen global coordinate system, for instance vehicles in a traffic scene. Notwithstanding the arbitrary global coordinate system, the governing dynamics of the respective dynamical systems are invariant to rotations and translations, also known as $\textit{Galilean invariance}$. As ignoring these invariances leads to worse generalization, in this work we propose local coordinate frames per node-object to induce roto-translation invariance to the geometric graph of the interacting dynamical system. Further, the local coordinate frames allow for a natural definition of anisotropic filtering in graph neural networks. Experiments in traffic scenes, 3D motion capture, and colliding particles demonstrate that the proposed approach comfortably outperforms the recent state-of-the-art.

Pre-trained language models have been successful in natural language generation (NLG) tasks. While various decoding methods have been employed, they often produce suboptimal results. We first present an empirical analysis of three NLG tasks: summarization, machine translation, and constrained text generation. We found that selecting the best output from the results of multiple decoding methods can significantly improve performance. To further improve reranking for NLG tasks, we proposed a novel method, \textsc{PairReranker}, which uses a single encoder and a pairwise loss function to jointly encode a source input and a pair of candidates and compare them. Experiments on three NLG tasks demonstrated the effectiveness and flexibility of \textsc{PairReranker}, showing strong results, compared with previous baselines. In addition, our \textsc{PairReranker} can generalize to significantly improve GPT-3 (text-davinci-003) results (e.g., 24.55\% on CommonGen and 11.35\% on WMT18 zh-en), even though our rerankers are not trained with any GPT-3 candidates.

Semantic communications seeks to transfer information from a source while conveying a desired meaning to its destination. We model the transmitter-receiver functionalities as an autoencoder followed by a task classifier that evaluates the meaning of the information conveyed to the receiver. The autoencoder consists of an encoder at the transmitter to jointly model source coding, channel coding, and modulation, and a decoder at the receiver to jointly model demodulation, channel decoding and source decoding. By augmenting the reconstruction loss with a semantic loss, the two deep neural networks (DNNs) of this encoder-decoder pair are interactively trained with the DNN of the semantic task classifier. This approach effectively captures the latent feature space and reliably transfers compressed feature vectors with a small number of channel uses while keeping the semantic loss low. We identify the multi-domain security vulnerabilities of using the DNNs for semantic communications. Based on adversarial machine learning, we introduce test-time (targeted and non-targeted) adversarial attacks on the DNNs by manipulating their inputs at different stages of semantic communications. As a computer vision attack, small perturbations are injected to the images at the input of the transmitter's encoder. As a wireless attack, small perturbations signals are transmitted to interfere with the input of the receiver's decoder. By launching these stealth attacks individually or more effectively in a combined form as a multi-domain attack, we show that it is possible to change the semantics of the transferred information even when the reconstruction loss remains low. These multi-domain adversarial attacks pose as a serious threat to the semantics of information transfer (with larger impact than conventional jamming) and raise the need of defense methods for the safe adoption of semantic communications.

This paper proposes a novel Adaptive Clustering-based Reduced-Order Modeling (ACROM) framework to significantly improve and extend the recent family of clustering-based reduced-order models (CROMs). This adaptive framework enables the clustering-based domain decomposition to evolve dynamically throughout the problem solution, ensuring optimum refinement in regions where the relevant fields present steeper gradients. It offers a new route to fast and accurate material modeling of history-dependent nonlinear problems involving highly localized plasticity and damage phenomena. The overall approach is composed of three main building blocks: target clusters selection criterion, adaptive cluster analysis, and computation of cluster interaction tensors. In addition, an adaptive clustering solution rewinding procedure and a dynamic adaptivity split factor strategy are suggested to further enhance the adaptive process. The coined Adaptive Self-Consistent Clustering Analysis (ASCA) is shown to perform better than its static counterpart when capturing the multi-scale elasto-plastic behavior of a particle-matrix composite and predicting the associated fracture and toughness. Given the encouraging results shown in this paper, the ACROM framework sets the stage and opens new avenues to explore adaptivity in the context of CROMs.

Robust Markov decision processes (RMDPs) are promising models that provide reliable policies under ambiguities in model parameters. As opposed to nominal Markov decision processes (MDPs), however, the state-of-the-art solution methods for RMDPs are limited to value-based methods, such as value iteration and policy iteration. This paper proposes Double-Loop Robust Policy Gradient (DRPG), the first generic policy gradient method for RMDPs with a global convergence guarantee in tabular problems. Unlike value-based methods, DRPG does not rely on dynamic programming techniques. In particular, the inner-loop robust policy evaluation problem is solved via projected gradient descent. Finally, our experimental results demonstrate the performance of our algorithm and verify our theoretical guarantees.

Despite recent progress towards scaling up multimodal vision-language models, these models are still known to struggle on compositional generalization benchmarks such as Winoground. We find that a critical component lacking from current vision-language models is relation-level alignment: the ability to match directional semantic relations in text (e.g., "mug in grass") with spatial relationships in the image (e.g., the position of the mug relative to the grass). To tackle this problem, we show that relation alignment can be enforced by encouraging the directed language attention from 'mug' to 'grass' (capturing the semantic relation 'in') to match the directed visual attention from the mug to the grass. Tokens and their corresponding objects are softly identified using the cross-modal attention. We prove that this notion of soft relation alignment is equivalent to enforcing congruence between vision and language attention matrices under a 'change of basis' provided by the cross-modal attention matrix. Intuitively, our approach projects visual attention into the language attention space to calculate its divergence from the actual language attention, and vice versa. We apply our Cross-modal Attention Congruence Regularization (CACR) loss to UNITER and improve on the state-of-the-art approach to Winoground.

The mechanism of existing style transfer algorithms is by minimizing a hybrid loss function to push the generated image toward high similarities in both content and style. However, this type of approach cannot guarantee visual fidelity, i.e., the generated artworks should be indistinguishable from real ones. In this paper, we devise a new style transfer framework called QuantArt for high visual-fidelity stylization. QuantArt pushes the latent representation of the generated artwork toward the centroids of the real artwork distribution with vector quantization. By fusing the quantized and continuous latent representations, QuantArt allows flexible control over the generated artworks in terms of content preservation, style similarity, and visual fidelity. Experiments on various style transfer settings show that our QuantArt framework achieves significantly higher visual fidelity compared with the existing style transfer methods.

Generating wind power scenarios is very important for studying the impacts of multiple wind farms that are interconnected to the grid. We develop a graph convolutional generative adversarial network (GCGAN) approach by leveraging GAN's capability in generating large number of realistic scenarios without using statistical modeling. Unlike existing GAN-based wind power data generation approaches, we design GAN's hidden layers to match the underlying spatial and temporal characteristics. We advocate to use graph filters to embed the spatial correlation among multiple wind farms, and a one-dimensional (1D) convolutional layer for representing the temporal feature filters. The proposed graph and feature filter designs significantly reduce the GAN model complexity, leading to improvements on the training efficiency and computation complexity. Numerical results using real wind power data from Australia demonstrate that the scenarios generated by the proposed GCGAN exhibit more realistic spatial and temporal statistics than other GAN-based outputs.

Automatic differentiation (AD) is a technique for computing the derivative of a function represented by a program. This technique is considered as the de-facto standard for computing the differentiation in many machine learning and optimisation software tools. Despite the practicality of this technique, the performance of the differentiated programs, especially for functional languages and in the presence of vectors, is suboptimal. We present an AD system for a higher-order functional array-processing language. The core functional language underlying this system simultaneously supports both source-to-source forward-mode AD and global optimisations such as loop transformations. In combination, gradient computation with forward-mode AD can be as efficient as reverse mode, and the Jacobian matrices required for numerical algorithms such as Gauss-Newton and Levenberg-Marquardt can be efficiently computed.

Riemannian geometry provides powerful tools to explore the latent space of generative models while preserving the inherent structure of the data manifold. Lengths, energies and volume measures can be derived from a pullback metric, defined through the immersion that maps the latent space to the data space. With this in mind, most generative models are stochastic, and so is the pullback metric. Manipulating stochastic objects is strenuous in practice. In order to perform operations such as interpolations, or measuring the distance between data points, we need a deterministic approximation of the pullback metric. In this work, we are defining a new metric as the expected length derived from the stochastic pullback metric. We show this metric is Finslerian, and we compare it with the expected pullback metric. In high dimensions, we show that the metrics converge to each other at a rate of $\mathcal{O}\left(\frac{1}{D}\right)$.

Text classifiers have promising applications in high-stake tasks such as resume screening and content moderation. These classifiers must be fair and avoid discriminatory decisions by being invariant to perturbations of sensitive attributes such as gender or ethnicity. However, there is a gap between human intuition about these perturbations and the formal similarity specifications capturing them. While existing research has started to address this gap, current methods are based on hardcoded word replacements, resulting in specifications with limited expressivity or ones that fail to fully align with human intuition (e.g., in cases of asymmetric counterfactuals). This work proposes novel methods for bridging this gap by discovering expressive and intuitive individual fairness specifications. We show how to leverage unsupervised style transfer and GPT-3's zero-shot capabilities to automatically generate expressive candidate pairs of semantically similar sentences that differ along sensitive attributes. We then validate the generated pairs via an extensive crowdsourcing study, which confirms that a lot of these pairs align with human intuition about fairness in the context of toxicity classification. Finally, we show how limited amounts of human feedback can be leveraged to learn a similarity specification that can be used to train downstream fairness-aware models.

State-of-the-art performance in electroencephalography (EEG) decoding tasks is currently often achieved with either Deep-Learning or Riemannian-Geometry-based decoders. Recently, there is growing interest in Deep Riemannian Networks (DRNs) possibly combining the advantages of both previous classes of methods. However, there are still a range of topics where additional insight is needed to pave the way for a more widespread application of DRNs in EEG. These include architecture design questions such as network size and end-to-end ability as well as model training questions. How these factors affect model performance has not been explored. Additionally, it is not clear how the data within these networks is transformed, and whether this would correlate with traditional EEG decoding. Our study aims to lay the groundwork in the area of these topics through the analysis of DRNs for EEG with a wide range of hyperparameters. Networks were tested on two public EEG datasets and compared with state-of-the-art ConvNets. Here we propose end-to-end EEG SPDNet (EE(G)-SPDNet), and we show that this wide, end-to-end DRN can outperform the ConvNets, and in doing so use physiologically plausible frequency regions. We also show that the end-to-end approach learns more complex filters than traditional band-pass filters targeting the classical alpha, beta, and gamma frequency bands of the EEG, and that performance can benefit from channel specific filtering approaches. Additionally, architectural analysis revealed areas for further improvement due to the possible loss of Riemannian specific information throughout the network. Our study thus shows how to design and train DRNs to infer task-related information from the raw EEG without the need of handcrafted filterbanks and highlights the potential of end-to-end DRNs such as EE(G)-SPDNet for high-performance EEG decoding.

Graph Neural Networks (GNNs) are a family of graph networks inspired by mechanisms existing between nodes on a graph. In recent years there has been an increased interest in GNN and their derivatives, i.e., Graph Attention Networks (GAT), Graph Convolutional Networks (GCN), and Graph Recurrent Networks (GRN). An increase in their usability in computer vision is also observed. The number of GNN applications in this field continues to expand; it includes video analysis and understanding, action and behavior recognition, computational photography, image and video synthesis from zero or few shots, and many more. This contribution aims to collect papers published about GNN-based approaches towards computer vision. They are described and summarized from three perspectives. Firstly, we investigate the architectures of Graph Neural Networks and their derivatives used in this area to provide accurate and explainable recommendations for the ensuing investigations. As for the other aspect, we also present datasets used in these works. Finally, using graph analysis, we also examine relations between GNN-based studies in computer vision and potential sources of inspiration identified outside of this field.

We describe an approach for empirical modeling of steel phase kinetics based on symbolic regression and genetic programming. The algorithm takes processed data gathered from dilatometer measurements and produces a system of differential equations that models the phase kinetics. Our initial results demonstrate that the proposed approach allows to identify compact differential equations that fit the data. The model predicts ferrite, pearlite and bainite formation for a single steel type. Martensite is not yet included in the model. Future work shall incorporate martensite and generalize to multiple steel types with different chemical compositions.

From smoothly pursuing moving objects to rapidly shifting gazes during visual search, humans employ a wide variety of eye movement strategies in different contexts. While eye movements provide a rich window into mental processes, building generative models of eye movements is notoriously difficult, and to date the computational objectives guiding eye movements remain largely a mystery. In this work, we tackled these problems in the context of a canonical spatial planning task, maze-solving. We collected eye movement data from human subjects and built deep generative models of eye movements using a novel differentiable architecture for gaze fixations and gaze shifts. We found that human eye movements are best predicted by a model that is optimized not to perform the task as efficiently as possible but instead to run an internal simulation of an object traversing the maze. This not only provides a generative model of eye movements in this task but also suggests a computational theory for how humans solve the task, namely that humans use mental simulation.

Data-driven models are central to scientific discovery. In efforts to achieve state-of-the-art model accuracy, researchers are employing increasingly complex machine learning algorithms that often outperform simple regressions in interpolative settings (e.g. random k-fold cross-validation) but suffer from poor extrapolation performance, portability, and human interpretability, which limits their potential for facilitating novel scientific insight. Here we examine the trade-off between model performance and interpretability across a broad range of science and engineering problems with an emphasis on materials science datasets. We compare the performance of black box random forest and neural network machine learning algorithms to that of single-feature linear regressions which are fitted using interpretable input features discovered by a simple random search algorithm. For interpolation problems, the average prediction errors of linear regressions were twice as high as those of black box models. Remarkably, when prediction tasks required extrapolation, linear models yielded average error only 5% higher than that of black box models, and outperformed black box models in roughly 40% of the tested prediction tasks, which suggests that they may be desirable over complex algorithms in many extrapolation problems because of their superior interpretability, computational overhead, and ease of use. The results challenge the common assumption that extrapolative models for scientific machine learning are constrained by an inherent trade-off between performance and interpretability.

For improving short-length codes, we demonstrate that classic decoders can also be used with real-valued, neural encoders, i.e., deep-learning based codeword sequence generators. Here, the classical decoder can be a valuable tool to gain insights into these neural codes and shed light on weaknesses. Specifically, the turbo-autoencoder is a recently developed channel coding scheme where both encoder and decoder are replaced by neural networks. We first show that the limited receptive field of convolutional neural network (CNN)-based codes enables the application of the BCJR algorithm to optimally decode them with feasible computational complexity. These maximum a posteriori (MAP) component decoders then are used to form classical (iterative) turbo decoders for parallel or serially concatenated CNN encoders, offering a close-to-maximum likelihood (ML) decoding of the learned codes. To the best of our knowledge, this is the first time that a classical decoding algorithm is applied to a non-trivial, real-valued neural code. Furthermore, as the BCJR algorithm is fully differentiable, it is possible to train, or fine-tune, the neural encoder in an end-to-end fashion.

The reward hypothesis posits that, "all of what we mean by goals and purposes can be well thought of as maximization of the expected value of the cumulative sum of a received scalar signal (reward)." We aim to fully settle this hypothesis. This will not conclude with a simple affirmation or refutation, but rather specify completely the implicit requirements on goals and purposes under which the hypothesis holds.

Recently it has been shown that state-of-the-art NLP models are vulnerable to adversarial attacks, where the predictions of a model can be drastically altered by slight modifications to the input (such as synonym substitutions). While several defense techniques have been proposed, and adapted, to the discrete nature of text adversarial attacks, the benefits of general-purpose regularization methods such as label smoothing for language models, have not been studied. In this paper, we study the adversarial robustness provided by various label smoothing strategies in foundational models for diverse NLP tasks in both in-domain and out-of-domain settings. Our experiments show that label smoothing significantly improves adversarial robustness in pre-trained models like BERT, against various popular attacks. We also analyze the relationship between prediction confidence and robustness, showing that label smoothing reduces over-confident errors on adversarial examples.

Overfitting is a problem in Convolutional Neural Networks (CNN) that causes poor generalization of models on unseen data. To remediate this problem, many new and diverse data augmentation methods (DA) have been proposed to supplement or generate more training data, and thereby increase its quality. In this work, we propose a new data augmentation algorithm: VoronoiPatches (VP). We primarily utilize non-linear recombination of information within an image, fragmenting and occluding small information patches. Unlike other DA methods, VP uses small convex polygon-shaped patches in a random layout to transport information around within an image. Sudden transitions created between patches and the original image can, optionally, be smoothed. In our experiments, VP outperformed current DA methods regarding model variance and overfitting tendencies. We demonstrate data augmentation utilizing non-linear re-combination of information within images, and non-orthogonal shapes and structures improves CNN model robustness on unseen data.

Text-based speech editing allows users to edit speech by intuitively cutting, copying, and pasting text to speed up the process of editing speech. In the previous work, CampNet (context-aware mask prediction network) is proposed to realize text-based speech editing, significantly improving the quality of edited speech. This paper aims at a new task: adding emotional effect to the editing speech during the text-based speech editing to make the generated speech more expressive. To achieve this task, we propose Emo-CampNet (emotion CampNet), which can provide the option of emotional attributes for the generated speech in text-based speech editing and has the one-shot ability to edit unseen speakers' speech. Firstly, we propose an end-to-end emotion-selectable text-based speech editing model. The key idea of the model is to control the emotion of generated speech by introducing additional emotion attributes based on the context-aware mask prediction network. Secondly, to prevent the emotion of the generated speech from being interfered by the emotional components in the original speech, a neutral content generator is proposed to remove the emotion from the original speech, which is optimized by the generative adversarial framework. Thirdly, two data augmentation methods are proposed to enrich the emotional and pronunciation information in the training set, which can enable the model to edit the unseen speaker's speech. The experimental results that 1) Emo-CampNet can effectively control the emotion of the generated speech in the process of text-based speech editing; And can edit unseen speakers' speech. 2) Detailed ablation experiments further prove the effectiveness of emotional selectivity and data augmentation methods. The demo page is available at https://hairuo55.github.io/Emo-CampNet/

Can a machine learn machine learning? We propose to answer this question using the same criteria we use to answer a similar question: can a human learn machine learning? We automatically answer final exams in MIT's, Harvard's and Cornell's large machine learning courses and generate new questions at a human level. Recently, program synthesis and few-shot learning solved university-level problem set questions in mathematics and STEM courses at a human level. In this work, we solve questions from final exams that differ from problem sets in several ways: the questions are longer, have multiple parts, are more complicated, and span a broader set of topics. We provide a new dataset and benchmark of questions from machine learning final exams and code for automatically answering these questions and generating new questions. To make our dataset a reproducible benchmark, we use automatic checkers for multiple choice questions, questions with numeric answers, and questions with expression answers, and evaluate a large free language model, Meta's OPT, and compare the results with Open AI's GPT-3, ChatGPT, and Codex. A student survey comparing the quality, appropriateness, and difficulty of machine-generated questions with human-written questions shows that across multiple aspects, machine-generated questions are indistinguishable from human-generated questions and are suitable for final exams. We perform ablation studies comparing zero-shot learning with few-shot learning, chain-of-thought prompting, GPT-3, ChatGPT, and OPT pre-trained on text and Codex fine-tuned on code on a range of machine learning topics and find that few-shot learning methods perform best. We make our data and code publicly available for the machine learning community.

We introduce organism networks, which function like a single neural network but are composed of several neural particle networks; while each particle network fulfils the role of a single weight application within the organism network, it is also trained to self-replicate its own weights. As organism networks feature vastly more parameters than simpler architectures, we perform our initial experiments on an arithmetic task as well as on simplified MNIST-dataset classification as a collective. We observe that individual particle networks tend to specialise in either of the tasks and that the ones fully specialised in the secondary task may be dropped from the network without hindering the computational accuracy of the primary task. This leads to the discovery of a novel pruning-strategy for sparse neural networks

We consider the problem of continually releasing an estimate of the population mean of a stream of samples that is user-level differentially private (DP). At each time instant, a user contributes a sample, and the users can arrive in arbitrary order. Until now these requirements of continual release and user-level privacy were considered in isolation. But, in practice, both these requirements come together as the users often contribute data repeatedly and multiple queries are made. We provide an algorithm that outputs a mean estimate at every time instant $t$ such that the overall release is user-level $\varepsilon$-DP and has the following error guarantee: Denoting by $M_t$ the maximum number of samples contributed by a user, as long as $\tilde{\Omega}(1/\varepsilon)$ users have $M_t/2$ samples each, the error at time $t$ is $\tilde{O}(1/\sqrt{t}+\sqrt{M}_t/t\varepsilon)$. This is a universal error guarantee which is valid for all arrival patterns of the users. Furthermore, it (almost) matches the existing lower bounds for the single-release setting at all time instants when users have contributed equal number of samples.

Despite their impressive performance on diverse tasks, large language models (LMs) still struggle with tasks requiring rich world knowledge, implying the limitations of relying solely on their parameters to encode a wealth of world knowledge. This paper aims to understand LMs' strengths and limitations in memorizing factual knowledge, by conducting large-scale knowledge probing experiments of 10 models and 4 augmentation methods on PopQA, our new open-domain QA dataset with 14k questions. We find that LMs struggle with less popular factual knowledge, and that scaling fails to appreciably improve memorization of factual knowledge in the tail. We then show that retrieval-augmented LMs largely outperform orders of magnitude larger LMs, while unassisted LMs remain competitive in questions about high-popularity entities. Based on those findings, we devise a simple, yet effective, method for powerful and efficient retrieval-augmented LMs, which retrieves non-parametric memories only when necessary. Experimental results show that this significantly improves models' performance while reducing the inference costs.

Models of sensory processing and learning in the cortex need to efficiently assign credit to synapses in all areas. In deep learning, a known solution is error backpropagation, which however requires biologically implausible weight transport from feed-forward to feedback paths. We introduce Phaseless Alignment Learning (PAL), a bio-plausible method to learn efficient feedback weights in layered cortical hierarchies. This is achieved by exploiting the noise naturally found in biophysical systems as an additional carrier of information. In our dynamical system, all weights are learned simultaneously with always-on plasticity and using only information locally available to the synapses. Our method is completely phase-free (no forward and backward passes or phased learning) and allows for efficient error propagation across multi-layer cortical hierarchies, while maintaining biologically plausible signal transport and learning. Our method is applicable to a wide class of models and improves on previously known biologically plausible ways of credit assignment: compared to random synaptic feedback, it can solve complex tasks with less neurons and learn more useful latent representations. We demonstrate this on various classification tasks using a cortical microcircuit model with prospective coding.

Transformers and variational autoencoders (VAE) have been extensively employed for symbolic (e.g., MIDI) domain music generation. While the former boast an impressive capability in modeling long sequences, the latter allow users to willingly exert control over different parts (e.g., bars) of the music to be generated. In this paper, we are interested in bringing the two together to construct a single model that exhibits both strengths. The task is split into two steps. First, we equip Transformer decoders with the ability to accept segment-level, time-varying conditions during sequence generation. Subsequently, we combine the developed and tested in-attention decoder with a Transformer encoder, and train the resulting MuseMorphose model with the VAE objective to achieve style transfer of long pop piano pieces, in which users can specify musical attributes including rhythmic intensity and polyphony (i.e., harmonic fullness) they desire, down to the bar level. Experiments show that MuseMorphose outperforms recurrent neural network (RNN) based baselines on numerous widely-used metrics for style transfer tasks.

Procuring expressive molecular representations underpins AI-driven molecule design and scientific discovery. The research mainly focuses on atom-level homogeneous molecular graphs, ignoring the rich information in subgraphs or motifs. However, it has been widely accepted that substructures play a dominant role in identifying and determining molecular properties. To address such issues, we formulate heterogeneous molecular graphs (HMGs), and introduce a novel architecture to exploit both molecular motifs and 3D geometry. Precisely, we extract functional groups as motifs for small molecules and employ reinforcement learning to adaptively select quaternary amino acids as motif candidates for proteins. Then HMGs are constructed with both atom-level and motif-level nodes. To better accommodate those HMGs, we introduce a variant of Transformer named Molformer, which adopts a heterogeneous self-attention layer to distinguish the interactions between multi-level nodes. Besides, it is also coupled with a multi-scale mechanism to capture fine-grained local patterns with increasing contextual scales. An attentive farthest point sampling algorithm is also proposed to obtain the molecular representations. We validate Molformer across a broad range of domains, including quantum chemistry, physiology, and biophysics. Extensive experiments show that Molformer outperforms or achieves the comparable performance of several state-of-the-art baselines. Our work provides a promising way to utilize informative motifs from the perspective of multi-level graph construction.

We study the problem of training a principal in a multi-agent general-sum game using reinforcement learning (RL). Learning a robust principal policy requires anticipating the worst possible strategic responses of other agents, which is generally NP-hard. However, we show that no-regret dynamics can identify these worst-case responses in poly-time in smooth games. We propose a framework that uses this policy evaluation method for efficiently learning a robust principal policy using RL. This framework can be extended to provide robustness to boundedly rational agents too. Our motivating application is automated mechanism design: we empirically demonstrate our framework learns robust mechanisms in both matrix games and complex spatiotemporal games. In particular, we learn a dynamic tax policy that improves the welfare of a simulated trade-and-barter economy by 15%, even when facing previously unseen boundedly rational RL taxpayers.

In the era of digital healthcare, the huge volumes of textual information generated every day in hospitals constitute an essential but underused asset that could be exploited with task-specific, fine-tuned biomedical language representation models, improving patient care and management. For such specialized domains, previous research has shown that fine-tuning models stemming from broad-coverage checkpoints can largely benefit additional training rounds over large-scale in-domain resources. However, these resources are often unreachable for less-resourced languages like Italian, preventing local medical institutions to employ in-domain adaptation. In order to reduce this gap, our work investigates two accessible approaches to derive biomedical language models in languages other than English, taking Italian as a concrete use-case: one based on neural machine translation of English resources, favoring quantity over quality; the other based on a high-grade, narrow-scoped corpus natively in Italian, thus preferring quality over quantity. Our study shows that data quantity is a harder constraint than data quality for biomedical adaptation, but the concatenation of high-quality data can improve model performance even when dealing with relatively size-limited corpora. The models published from our investigations have the potential to unlock important research opportunities for Italian hospitals and academia. Finally, the set of lessons learned from the study constitutes valuable insights towards a solution to build biomedical language models that are generalizable to other less-resourced languages and different domain settings.

Scaling up language models has led to unprecedented performance gains, but little is understood about how the training dynamics change as models get larger. How do language models of different sizes learn during pre-training? Why do larger language models demonstrate more desirable behaviors? In this paper, we analyze the intermediate training checkpoints of differently sized OPT models (Zhang et al.,2022)--from 125M to 175B parameters--on next-token prediction, sequence-level generation, and downstream tasks. We find that 1) at a given perplexity and independent of model sizes, a similar subset of training tokens see the most significant reduction in loss, with the rest stagnating or showing double-descent behavior; 2) early in training, all models learn to reduce the perplexity of grammatical sequences that contain hallucinations, with small models halting at this suboptimal distribution and larger ones eventually learning to assign these sequences lower probabilities; 3) perplexity is a strong predictor of in-context learning performance on 74 multiple-choice tasks from BIG-Bench, and this holds independent of the model size. Together, these results show that perplexity is more predictive of model behaviors than model size or training computation.

Transformers have been essential to pretraining success in NLP. Other architectures have been used, but require attention layers to match benchmark accuracy. This work explores pretraining without attention. We test recently developed routing layers based on state-space models (SSM) and model architectures based on multiplicative gating. Used together these modeling choices have a large impact on pretraining accuracy. Empirically the proposed Bidirectional Gated SSM (BiGS) replicates BERT pretraining results without attention and can be extended to long-form pretraining of 4096 tokens without approximation.

Differentially private algorithms for common metric aggregation tasks, such as clustering or averaging, often have limited practicality due to their complexity or to the large number of data points that is required for accurate results. We propose a simple and practical tool, $\mathsf{FriendlyCore}$, that takes a set of points ${\cal D}$ from an unrestricted (pseudo) metric space as input. When ${\cal D}$ has effective diameter $r$, $\mathsf{FriendlyCore}$ returns a "stable" subset ${\cal C} \subseteq {\cal D}$ that includes all points, except possibly few outliers, and is {\em certified} to have diameter $r$. $\mathsf{FriendlyCore}$ can be used to preprocess the input before privately aggregating it, potentially simplifying the aggregation or boosting its accuracy. Surprisingly, $\mathsf{FriendlyCore}$ is light-weight with no dependence on the dimension. We empirically demonstrate its advantages in boosting the accuracy of mean estimation and clustering tasks such as $k$-means and $k$-GMM, outperforming tailored methods.

Effective and adaptive interference management is required in next generation wireless communication systems. To address this challenge, Rate-Splitting Multiple Access (RSMA), relying on multi-antenna rate-splitting (RS) at the transmitter and successive interference cancellation (SIC) at the receivers, has been intensively studied in recent years, albeit mostly under the assumption of perfect Channel State Information at the Receiver (CSIR) and ideal capacity-achieving modulation and coding schemes. To assess its practical performance, benefits, and limits under more realistic conditions, this work proposes a novel design for a practical RSMA receiver based on model-based deep learning (MBDL) methods, which aims to unite the simple structure of the conventional SIC receiver and the robustness and model agnosticism of deep learning techniques. The MBDL receiver is evaluated in terms of uncoded Symbol Error Rate (SER), throughput performance through Link-Level Simulations (LLS), and average training overhead. Also, a comparison with the SIC receiver, with perfect and imperfect CSIR, is given. Results reveal that the MBDL receiver outperforms by a significant margin the SIC receiver with imperfect CSIR, due to its ability to generate on demand non-linear symbol detection boundaries in a pure data-driven manner.

The evolution of wireless communications into 6G and beyond is expected to rely on new machine learning (ML)-based capabilities. These can enable proactive decisions and actions from wireless-network components to sustain quality-of-service (QoS) and user experience. Moreover, new use cases in the area of vehicular and industrial communications will emerge. Specifically in the area of vehicle communication, vehicle-to-everything (V2X) schemes will benefit strongly from such advances. With this in mind, we have conducted a detailed measurement campaign with the purpose of enabling a plethora of diverse ML-based studies. The resulting datasets offer GPS-located wireless measurements across diverse urban environments for both cellular (with two different operators) and sidelink radio access technologies, thus enabling a variety of different studies towards V2X. The datasets are labeled and sampled with a high time resolution. Furthermore, we make the data publicly available with all the necessary information to support the on-boarding of new researchers. We provide an initial analysis of the data showing some of the challenges that ML needs to overcome and the features that ML can leverage, as well as some hints at potential research studies.

We develop data-driven methods incorporating geometric and topological information to learn parsimonious representations of nonlinear dynamics from observations. We develop approaches for learning nonlinear state space models of the dynamics for general manifold latent spaces using training strategies related to Variational Autoencoders (VAEs). Our methods are referred to as Geometric Dynamic (GD) Variational Autoencoders (GD-VAEs). We learn encoders and decoders for the system states and evolution based on deep neural network architectures that include general Multilayer Perceptrons (MLPs), Convolutional Neural Networks (CNNs), and Transpose CNNs (T-CNNs). Motivated by problems arising in parameterized PDEs and physics, we investigate the performance of our methods on tasks for learning low dimensional representations of the nonlinear Burgers equations, constrained mechanical systems, and spatial fields of reaction-diffusion systems. GD-VAEs provide methods for obtaining representations for use in diverse learning tasks involving dynamics.

Adversarial training is a method for enhancing neural networks to improve the robustness against adversarial examples. Besides the security concerns of potential adversarial examples, adversarial training can also improve the generalization ability of neural networks, train robust neural networks, and provide interpretability for neural networks. In this work, we introduce adversarial training in time series analysis to enhance the neural networks for better generalization ability by taking the finance field as an example. Rethinking existing research on adversarial training, we propose the adaptively scaled adversarial training (ASAT) in time series analysis, by rescaling data at different time slots with adaptive scales. Experimental results show that the proposed ASAT can improve both the generalization ability and the adversarial robustness of neural networks compared to the baselines. Compared to the traditional adversarial training algorithm, ASAT can achieve better generalization ability and similar adversarial robustness.

Learning to rank is an effective recommendation approach since its introduction around 2010. Famous algorithms such as Bayesian Personalized Ranking and Collaborative Less is More Filtering have left deep impact in both academia and industry. However, most learning to rank approaches focus on improving technical accuracy metrics such as AUC, MRR and NDCG. Other evaluation metrics of recommender systems like fairness have been largely overlooked until in recent years. In this paper, we propose a new learning to rank algorithm named Pareto Pairwise Ranking. We are inspired by the idea of Bayesian Personalized Ranking and power law distribution. We show that our algorithm is competitive with other algorithms when evaluated on technical accuracy metrics. What is more important, in our experiment section we demonstrate that Pareto Pairwise Ranking is the most fair algorithm in comparison with 9 other contemporary algorithms.

Domain adaptation of GANs is a problem of fine-tuning the state-of-the-art GAN models (e.g. StyleGAN) pretrained on a large dataset to a specific domain with few samples (e.g. painting faces, sketches, etc.). While there are a great number of methods that tackle this problem in different ways there are still many important questions that remain unanswered. In this paper, we provide a systematic and in-depth analysis of the domain adaptation problem of GANs, focusing on the StyleGAN model. First, we perform a detailed exploration of the most important parts of StyleGAN that are responsible for adapting the generator to a new domain depending on the similarity between the source and target domains. In particular, we show that affine layers of StyleGAN can be sufficient for fine-tuning to similar domains. Second, inspired by these findings, we investigate StyleSpace to utilize it for domain adaptation. We show that there exist directions in the StyleSpace that can adapt StyleGAN to new domains. Further, we examine these directions and discover their many surprising properties. Finally, we leverage our analysis and findings to deliver practical improvements and applications in such standard tasks as image-to-image translation and cross-domain morphing.

This report summarizes the 3rd International Verification of Neural Networks Competition (VNN-COMP 2022), held as a part of the 5th Workshop on Formal Methods for ML-Enabled Autonomous Systems (FoMLAS), which was collocated with the 34th International Conference on Computer-Aided Verification (CAV). VNN-COMP is held annually to facilitate the fair and objective comparison of state-of-the-art neural network verification tools, encourage the standardization of tool interfaces, and bring together the neural network verification community. To this end, standardized formats for networks (ONNX) and specification (VNN-LIB) were defined, tools were evaluated on equal-cost hardware (using an automatic evaluation pipeline based on AWS instances), and tool parameters were chosen by the participants before the final test sets were made public. In the 2022 iteration, 11 teams participated on a diverse set of 12 scored benchmarks. This report summarizes the rules, benchmarks, participating tools, results, and lessons learned from this iteration of this competition.

Multivariate time series forecasting constitutes important functionality in cyber-physical systems, whose prediction accuracy can be improved significantly by capturing temporal and multivariate correlations among multiple time series. State-of-the-art deep learning methods fail to construct models for full time series because model complexity grows exponentially with time series length. Rather, these methods construct local temporal and multivariate correlations within subsequences, but fail to capture correlations among subsequences, which significantly affect their forecasting accuracy. To capture the temporal and multivariate correlations among subsequences, we design a pattern discovery model, that constructs correlations via diverse pattern functions. While the traditional pattern discovery method uses shared and fixed pattern functions that ignore the diversity across time series. We propose a novel pattern discovery method that can automatically capture diverse and complex time series patterns. We also propose a learnable correlation matrix, that enables the model to capture distinct correlations among multiple time series. Extensive experiments show that our model achieves state-of-the-art prediction accuracy.

With the development of a series of Galaxy sky surveys in recent years, the observations increased rapidly, which makes the research of machine learning methods for galaxy image recognition a hot topic. Available automatic galaxy image recognition researches are plagued by the large differences in similarity between categories, the imbalance of data between different classes, and the discrepancy between the discrete representation of Galaxy classes and the essentially gradual changes from one morphological class to the adjacent class (DDRGC). These limitations have motivated several astronomers and machine learning experts to design projects with improved galaxy image recognition capabilities. Therefore, this paper proposes a novel learning method, ``Hierarchical Imbalanced data learning with Weighted sampling and Label smoothing" (HIWL). The HIWL consists of three key techniques respectively dealing with the above-mentioned three problems: (1) Designed a hierarchical galaxy classification model based on an efficient backbone network; (2) Utilized a weighted sampling scheme to deal with the imbalance problem; (3) Adopted a label smoothing technique to alleviate the DDRGC problem. We applied this method to galaxy photometric images from the Galaxy Zoo-The Galaxy Challenge, exploring the recognition of completely round smooth, in between smooth, cigar-shaped, edge-on and spiral. The overall classification accuracy is 96.32\%, and some superiorities of the HIWL are shown based on recall, precision, and F1-Score in comparing with some related works. In addition, we also explored the visualization of the galaxy image features and model attention to understand the foundations of the proposed scheme.

Neural Networks (GNNs) have revolutionized the molecular discovery to understand patterns and identify unknown features that can aid in predicting biophysical properties and protein-ligand interactions. However, current models typically rely on 2-dimensional molecular representations as input, and while utilization of 2\3- dimensional structural data has gained deserved traction in recent years as many of these models are still limited to static graph representations. We propose a novel approach based on the transformer model utilizing GNNs for characterizing dynamic features of protein-ligand interactions. Our message passing transformer pre-trains on a set of molecular dynamic data based off of physics-based simulations to learn coordinate construction and make binding probability and affinity predictions as a downstream task. Through extensive testing we compare our results with the existing models, our MDA-PLI model was able to outperform the molecular interaction prediction models with an RMSE of 1.2958. The geometric encodings enabled by our transformer architecture and the addition of time series data add a new dimensionality to this form of research.

As the complexity of modern software continues to escalate, software engineering has become an increasingly daunting and error-prone endeavor. In recent years, the field of Neural Code Intelligence (NCI) has emerged as a promising solution, leveraging the power of deep learning techniques to tackle analytical tasks on source code with the goal of improving programming efficiency and minimizing human errors within the software industry. Pretrained language models have become a dominant force in NCI research, consistently delivering state-of-the-art results across a wide range of tasks, including code summarization, generation, and translation. In this paper, we present a comprehensive survey of the NCI domain, including a thorough review of pretraining techniques, tasks, datasets, and model architectures. We hope this paper will serve as a bridge between the natural language and programming language communities, offering insights for future research in this rapidly evolving field.

One of the primary goals in spectrum occupancy mapping is to create a system that is robust to assumptions about the number of sensors, occupancy threshold (in dBm), sensor noise, number of emitters and the propagation environment. We show that such a system may be designed with neural networks using a process of aggregation to allow a variable number of sensors during training and testing. This process transforms the variable number of measurements into log-likelihood ratios (LLRs), which are fed as a fixed-resolution image into a neural network. The use of LLRs provides robustness to the effects of noise and occupancy threshold. In other words, a system may be trained for a nominal number of sensors, threshold and noise levels, and still operate well at various other levels without retraining. Our system operates without knowledge of the number of emitters and does not explicitly attempt to estimate their number or power. Receiver operating curves with realistic propagation environments using topographic maps with commercial network design tools show how performance of the neural network varies with the environment. The use of low-resolution sensors in this system does not significantly hurt performance.  ( 2 min )

This contribution demonstrates the feasibility of applying Generative Adversarial Networks (GANs) on images of EPAL pallet blocks for dataset enhancement in the context of re-identification. For many industrial applications of re-identification methods, datasets of sufficient volume would otherwise be unattainable in non-laboratory settings. Using a state-of-the-art GAN architecture, namely CycleGAN, images of pallet blocks rotated to their left-hand side were generated from images of visually centered pallet blocks, based on images of rotated pallet blocks that were recorded as part of a previously recorded and published dataset. In this process, the unique chipwood pattern of the pallet block surface structure was retained, only changing the orientation of the pallet block itself. By doing so, synthetic data for re-identification testing and training purposes was generated, in a manner that is distinct from ordinary data augmentation. In total, 1,004 new images of pallet blocks were generated. The quality of the generated images was gauged using a perspective classifier that was trained on the original images and then applied to the synthetic ones, comparing the accuracy between the two sets of images. The classification accuracy was 98% for the original images and 92% for the synthetic images. In addition, the generated images were also used in a re-identification task, in order to re-identify original images based on synthetic ones. The accuracy in this scenario was up to 88% for synthetic images, compared to 96% for original images. Through this evaluation, it is established, whether or not a generated pallet block image closely resembles its original counterpart.  ( 2 min )

Deep neural networks (DNN) are prone to miscalibrated predictions, often exhibiting a mismatch between the predicted output and the associated confidence scores. Contemporary model calibration techniques mitigate the problem of overconfident predictions by pushing down the confidence of the winning class while increasing the confidence of the remaining classes across all test samples. However, from a deployment perspective, an ideal model is desired to (i) generate well-calibrated predictions for high-confidence samples with predicted probability say >0.95, and (ii) generate a higher proportion of legitimate high-confidence samples. To this end, we propose a novel regularization technique that can be used with classification losses, leading to state-of-the-art calibrated predictions at test time; From a deployment standpoint in safety-critical applications, only high-confidence samples from a well-calibrated model are of interest, as the remaining samples have to undergo manual inspection. Predictive confidence reduction of these potentially ``high-confidence samples'' is a downside of existing calibration approaches. We mitigate this by proposing a dynamic train-time data pruning strategy that prunes low-confidence samples every few epochs, providing an increase in "confident yet calibrated samples". We demonstrate state-of-the-art calibration performance across image classification benchmarks, reducing training time without much compromise in accuracy. We provide insights into why our dynamic pruning strategy that prunes low-confidence training samples leads to an increase in high-confidence samples at test time.  ( 2 min )

This paper concerns with statistical estimation and inference for the ranking problems based on pairwise comparisons with additional covariate information such as the attributes of the compared items. Despite extensive studies, few prior literatures investigate this problem under the more realistic setting where covariate information exists. To tackle this issue, we propose a novel model, Covariate-Assisted Ranking Estimation (CARE) model, that extends the well-known Bradley-Terry-Luce (BTL) model, by incorporating the covariate information. Specifically, instead of assuming every compared item has a fixed latent score $\{\theta_i^*\}_{i=1}^n$, we assume the underlying scores are given by $\{\alpha_i^*+{x}_i^\top\beta^*\}_{i=1}^n$, where $\alpha_i^*$ and ${x}_i^\top\beta^*$ represent latent baseline and covariate score of the $i$-th item, respectively. We impose natural identifiability conditions and derive the $\ell_{\infty}$- and $\ell_2$-optimal rates for the maximum likelihood estimator of $\{\alpha_i^*\}_{i=1}^{n}$ and $\beta^*$ under a sparse comparison graph, using a novel `leave-one-out' technique (Chen et al., 2019) . To conduct statistical inferences, we further derive asymptotic distributions for the MLE of $\{\alpha_i^*\}_{i=1}^n$ and $\beta^*$ with minimal sample complexity. This allows us to answer the question whether some covariates have any explanation power for latent scores and to threshold some sparse parameters to improve the ranking performance. We improve the approximation method used in (Gao et al., 2021) for the BLT model and generalize it to the CARE model. Moreover, we validate our theoretical results through large-scale numerical studies and an application to the mutual fund stock holding dataset.  ( 2 min )

A long-standing goal of machine-learning-based protein engineering is to accelerate the discovery of novel mutations that improve the function of a known protein. We introduce a sampling framework for evolving proteins in silico that supports mixing and matching a variety of unsupervised models, such as protein language models, and supervised models that predict protein function from sequence. By composing these models, we aim to improve our ability to evaluate unseen mutations and constrain search to regions of sequence space likely to contain functional proteins. Our framework achieves this without any model fine-tuning or re-training by constructing a product of experts distribution directly in discrete protein space. Instead of resorting to brute force search or random sampling, which is typical of classic directed evolution, we introduce a fast MCMC sampler that uses gradients to propose promising mutations. We conduct in silico directed evolution experiments on wide fitness landscapes and across a range of different pre-trained unsupervised models, including a 650M parameter protein language model. Our results demonstrate an ability to efficiently discover variants with high evolutionary likelihood as well as estimated activity multiple mutations away from a wild type protein, suggesting our sampler provides a practical and effective new paradigm for machine-learning-based protein engineering.  ( 2 min )

In this paper, we introduce a novel optimization algorithm for machine learning model training called Normalized Stochastic Gradient Descent (NSGD) inspired by Normalized Least Mean Squares (NLMS) from adaptive filtering. When we train a high-complexity model on a large dataset, the learning rate is significantly important as a poor choice of optimizer parameters can lead to divergence. The algorithm updates the new set of network weights using the stochastic gradient but with $\ell_1$ and $\ell_2$-based normalizations on the learning rate parameter similar to the NLMS algorithm. Our main difference from the existing normalization methods is that we do not include the error term in the normalization process. We normalize the update term using the input vector to the neuron. Our experiments present that the model can be trained to a better accuracy level on different initial settings using our optimization algorithm. In this paper, we demonstrate the efficiency of our training algorithm using ResNet-20 and a toy neural network on different benchmark datasets with different initializations. The NSGD improves the accuracy of the ResNet-20 from 91.96\% to 92.20\% on the CIFAR-10 dataset.  ( 2 min )

Recent advances in deep learning research, such as transformers, have bolstered the ability for automated agents to generate creative texts similar to those that a human would write. By default, transformer decoders can only generate new text with respect to previously generated text. The output distribution of candidate tokens at any position is conditioned on previously selected tokens using a self-attention mechanism to emulate the property of autoregression. This is inherently limiting for tasks such as controllable story generation where it may be necessary to condition on future plot events when writing a story. In this work, we propose Future Sight, a method for finetuning a pretrained generative transformer on the task of future conditioning. Transformer decoders are typically pretrained on the task of completing a context, one token at a time, by means of self-attention. Future Sight additionally enables a decoder to attend to an encoded future plot event. This motivates the decoder to expand on the context in a way that logically concludes with the provided future. During inference, the future plot event can be written by a human author to steer the narrative being generated in a certain direction. We evaluate the efficacy of our approach on a story generation task with human evaluators.  ( 2 min )

Keyword spotting (KWS) based on deep neural networks (DNNs) has achieved massive success in voice control scenarios. However, training of such DNN-based KWS systems often requires significant data and hardware resources. Manufacturers often entrust this process to a third-party platform. This makes the training process uncontrollable, where attackers can implant backdoors in the model by manipulating third-party training data. An effective backdoor attack can force the model to make specified judgments under certain conditions, i.e., triggers. In this paper, we design a backdoor attack scheme based on Voiceprint Selection and Voice Conversion, abbreviated as VSVC. Experimental results demonstrated that VSVC is feasible to achieve an average attack success rate close to 97% in four victim models when poisoning less than 1% of the training data.  ( 2 min )

We demonstrate a Physics-informed Neural Network (PINN) based model for real-time health monitoring of a heat exchanger, that plays a critical role in improving energy efficiency of thermal power plants. A hypernetwork based approach is used to enable the domain-decomposed PINN learn the thermal behavior of the heat exchanger in response to dynamic boundary conditions, eliminating the need to re-train. As a result, we achieve orders of magnitude reduction in inference time in comparison to existing PINNs, while maintaining the accuracy on par with the physics-based simulations. This makes the approach very attractive for predictive maintenance of the heat exchanger in digital twin environments.  ( 2 min )

Fine-tuning pre-trained language models has become the prevalent paradigm for building downstream NLP models. Oftentimes fine-tuned models are readily available but their training data is not, due to data privacy or intellectual property concerns. This creates a barrier to fusing knowledge across individual models to yield a better single model. In this paper, we study the problem of merging individual models built on different training data sets to obtain a single model that performs well both across all data set domains and can generalize on out-of-domain data. We propose a dataless knowledge fusion method that merges models in their parameter space, guided by weights that minimize prediction differences between the merged model and the individual models. Over a battery of evaluation settings, we show that the proposed method significantly outperforms baselines such as Fisher-weighted averaging or model ensembling. Further, we find that our method is a promising alternative to multi-task learning that can preserve or sometimes improve over the individual models without access to the training data. Finally, model merging is more efficient than training a multi-task model, thus making it applicable to a wider set of scenarios.  ( 2 min )

Recently, online social media has become a primary source for new information and misinformation or rumours. In the absence of an automatic rumour detection system the propagation of rumours has increased manifold leading to serious societal damages. In this work, we propose a novel method for building automatic rumour detection system by focusing on oversampling to alleviating the fundamental challenges of class imbalance in rumour detection task. Our oversampling method relies on contextualised data augmentation to generate synthetic samples for underrepresented classes in the dataset. The key idea exploits selection of tweets in a thread for augmentation which can be achieved by introducing a non-random selection criteria to focus the augmentation process on relevant tweets. Furthermore, we propose two graph neural networks(GNN) to model non-linear conversations on a thread. To enhance the tweet representations in our method we employed a custom feature selection technique based on state-of-the-art BERTweet model. Experiments of three publicly available datasets confirm that 1) our GNN models outperform the the current state-of-the-art classifiers by more than 20%(F1-score); 2) our oversampling technique increases the model performance by more than 9%;(F1-score) 3) focusing on relevant tweets for data augmentation via non-random selection criteria can further improve the results; and 4) our method has superior capabilities to detect rumours at very early stage.  ( 2 min )

This paper studies offline policy learning, which aims at utilizing observations collected a priori (from either fixed or adaptively evolving behavior policies) to learn an optimal individualized decision rule that achieves the best overall outcomes for a given population. Existing policy learning methods rely on a uniform overlap assumption, i.e., the propensities of exploring all actions for all individual characteristics are lower bounded in the offline dataset; put differently, the performance of the existing methods depends on the worst-case propensity in the offline dataset. As one has no control over the data collection process, this assumption can be unrealistic in many situations, especially when the behavior policies are allowed to evolve over time with diminishing propensities for certain actions. In this paper, we propose a new algorithm that optimizes lower confidence bounds (LCBs) -- instead of point estimates -- of the policy values. The LCBs are constructed using knowledge of the behavior policies for collecting the offline data. Without assuming any uniform overlap condition, we establish a data-dependent upper bound for the suboptimality of our algorithm, which only depends on (i) the overlap for the optimal policy, and (ii) the complexity of the policy class we optimize over. As an implication, for adaptively collected data, we ensure efficient policy learning as long as the propensities for optimal actions are lower bounded over time, while those for suboptimal ones are allowed to diminish arbitrarily fast. In our theoretical analysis, we develop a new self-normalized type concentration inequality for inverse-propensity-weighting estimators, generalizing the well-known empirical Bernstein's inequality to unbounded and non-i.i.d. data.  ( 2 min )

Complex and contact-rich robotic manipulation tasks, particularly those that involve multi-fingered hands and underactuated object manipulation, present a significant challenge to any control method. Methods based on reinforcement learning offer an appealing choice for such settings, as they can enable robots to learn to delicately balance contact forces and dexterously reposition objects without strong modeling assumptions. However, running reinforcement learning on real-world dexterous manipulation systems often requires significant manual engineering. This negates the benefits of autonomous data collection and ease of use that reinforcement learning should in principle provide. In this paper, we describe a system for vision-based dexterous manipulation that provides a "programming-free" approach for users to define new tasks and enable robots with complex multi-fingered hands to learn to perform them through interaction. The core principle underlying our system is that, in a vision-based setting, users should be able to provide high-level intermediate supervision that circumvents challenges in teleoperation or kinesthetic teaching which allow a robot to not only learn a task efficiently but also to autonomously practice. Our system includes a framework for users to define a final task and intermediate sub-tasks with image examples, a reinforcement learning procedure that learns the task autonomously without interventions, and experimental results with a four-finger robotic hand learning multi-stage object manipulation tasks directly in the real world, without simulation, manual modeling, or reward engineering.  ( 2 min )

We present a machine-learning framework to accurately characterize morphologies of Active Galactic Nucleus (AGN) host galaxies within $z<1$. We first use PSFGAN to decouple host galaxy light from the central point source, then we invoke the Galaxy Morphology Network (GaMorNet) to estimate whether the host galaxy is disk-dominated, bulge-dominated, or indeterminate. Using optical images from five bands of the HSC Wide Survey, we build models independently in three redshift bins: low $(0<z<0.25)$, medium $(0.25<z<0.5)$, and high $(0.5<z<1.0)$. By first training on a large number of simulated galaxies, then fine-tuning using far fewer classified real galaxies, our framework predicts the actual morphology for $\sim$ $60\%-70\%$ host galaxies from test sets, with a classification precision of $\sim$ $80\%-95\%$, depending on redshift bin. Specifically, our models achieve disk precision of $96\%/82\%/79\%$ and bulge precision of $90\%/90\%/80\%$ (for the 3 redshift bins), at thresholds corresponding to indeterminate fractions of $30\%/43\%/42\%$. The classification precision of our models has a noticeable dependency on host galaxy radius and magnitude. No strong dependency is observed on contrast ratio. Comparing classifications of real AGNs, our models agree well with traditional 2D fitting with GALFIT. The PSFGAN+GaMorNet framework does not depend on the choice of fitting functions or galaxy-related input parameters, runs orders of magnitude faster than GALFIT, and is easily generalizable via transfer learning, making it an ideal tool for studying AGN host galaxy morphology in forthcoming large imaging survey.  ( 2 min )

Course load analytics (CLA) inferred from LMS and enrollment features can offer a more accurate representation of course workload to students than credit hours and potentially aid in their course selection decisions. In this study, we produce and evaluate the first machine-learned predictions of student course load ratings and generalize our model to the full 10,000 course catalog of a large public university. We then retrospectively analyze longitudinal differences in the semester load of student course selections throughout their degree. CLA by semester shows that a student's first semester at the university is among their highest load semesters, as opposed to a credit hour-based analysis, which would indicate it is among their lowest. Investigating what role predicted course load may play in program retention, we find that students who maintain a semester load that is low as measured by credit hours but high as measured by CLA are more likely to leave their program of study. This discrepancy in course load is particularly pertinent in STEM and associated with high prerequisite courses. Our findings have implications for academic advising, institutional handling of the freshman experience, and student-facing analytics to help students better plan, anticipate, and prepare for their selected courses.  ( 2 min )

Recently, Person Re-Identification (Re-ID) has received a lot of attention. Large datasets containing labeled images of various individuals have been released, allowing researchers to develop and test many successful approaches. However, when such Re-ID models are deployed in new cities or environments, the task of searching for people within a network of security cameras is likely to face an important domain shift, thus resulting in decreased performance. Indeed, while most public datasets were collected in a limited geographic area, images from a new city present different features (e.g., people's ethnicity and clothing style, weather, architecture, etc.). In addition, the whole frames of the video streams must be converted into cropped images of people using pedestrian detection models, which behave differently from the human annotators who created the dataset used for training. To better understand the extent of this issue, this paper introduces a complete methodology to evaluate Re-ID approaches and training datasets with respect to their suitability for unsupervised deployment for live operations. This method is used to benchmark four Re-ID approaches on three datasets, providing insight and guidelines that can help to design better Re-ID pipelines in the future.  ( 2 min )

Bayesian methods, distributionally robust optimization methods, and regularization methods are three pillars of trustworthy machine learning hedging against distributional uncertainty, e.g., the uncertainty of an empirical distribution compared to the true underlying distribution. This paper investigates the connections among the three frameworks and, in particular, explores why these frameworks tend to have smaller generalization errors. Specifically, first, we suggest a quantitative definition for "distributional robustness", propose the concept of "robustness measure", and formalize several philosophical concepts in distributionally robust optimization. Second, we show that Bayesian methods are distributionally robust in the probably approximately correct (PAC) sense; In addition, by constructing a Dirichlet-process-like prior in Bayesian nonparametrics, it can be proven that any regularized empirical risk minimization method is equivalent to a Bayesian method. Third, we show that generalization errors of machine learning models can be characterized using the distributional uncertainty of the nominal distribution and the robustness measures of these machine learning models, which is a new perspective to bound generalization errors, and therefore, explain the reason why distributionally robust machine learning models, Bayesian models, and regularization models tend to have smaller generalization errors.  ( 2 min )

Nonnegative matrix factorization can be used to automatically detect topics within a corpus in an unsupervised fashion. The technique amounts to an approximation of a nonnegative matrix as the product of two nonnegative matrices of lower rank. In this paper, we show this factorization can be combined with regression on a continuous response variable. In practice, the method performs better than regression done after topics are identified and retrains interpretability.  ( 2 min )

We develop data-driven methods incorporating geometric and topological information to learn parsimonious representations of nonlinear dynamics from observations. We develop approaches for learning nonlinear state space models of the dynamics for general manifold latent spaces using training strategies related to Variational Autoencoders (VAEs). Our methods are referred to as Geometric Dynamic (GD) Variational Autoencoders (GD-VAEs). We learn encoders and decoders for the system states and evolution based on deep neural network architectures that include general Multilayer Perceptrons (MLPs), Convolutional Neural Networks (CNNs), and Transpose CNNs (T-CNNs). Motivated by problems arising in parameterized PDEs and physics, we investigate the performance of our methods on tasks for learning low dimensional representations of the nonlinear Burgers equations, constrained mechanical systems, and spatial fields of reaction-diffusion systems. GD-VAEs provide methods for obtaining representations for use in diverse learning tasks involving dynamics.

Forecasting and decision-making are generally modeled as two sequential steps with no feedback, following an open-loop approach. In this paper, we present application-driven learning, a new closed-loop framework in which the processes of forecasting and decision-making are merged and co-optimized through a bilevel optimization problem. We present our methodology in a general format and prove that the solution converges to the best estimator in terms of the expected cost of the selected application. Then, we propose two solution methods: an exact method based on the KKT conditions of the second-level problem and a scalable heuristic approach suitable for decomposition methods. The proposed methodology is applied to the relevant problem of defining dynamic reserve requirements and conditional load forecasts, offering an alternative approach to current \emph{ad hoc} procedures implemented in industry practices. We benchmark our methodology with the standard sequential least-squares forecast and dispatch planning process. We apply the proposed methodology to an illustrative system and to a wide range of instances, from dozens of buses to large-scale realistic systems with thousands of buses. Our results show that the proposed methodology is scalable and yields consistently better performance than the standard open-loop approach.

We study the linear contextual bandit problem where an agent has to select one candidate from a pool and each candidate belongs to a sensitive group. In this setting, candidates' rewards may not be directly comparable between groups, for example when the agent is an employer hiring candidates from different ethnic groups and some groups have a lower reward due to discriminatory bias and/or social injustice. We propose a notion of fairness that states that the agent's policy is fair when it selects a candidate with highest relative rank, which measures how good the reward is when compared to candidates from the same group. This is a very strong notion of fairness, since the relative rank is not directly observed by the agent and depends on the underlying reward model and on the distribution of rewards. Thus we study the problem of learning a policy which approximates a fair policy under the condition that the contexts are independent between groups and the distribution of rewards of each group is absolutely continuous. In particular, we design a greedy policy which at each round constructs a ridge regression estimate from the observed context-reward pairs, and then computes an estimate of the relative rank of each candidate using the empirical cumulative distribution function. We prove that, despite its simplicity and the lack of an initial exploration phase, the greedy policy achieves, up to log factors and with high probability, a fair pseudo-regret of order $\sqrt{dT}$ after $T$ rounds, where $d$ is the dimension of the context vectors. The policy also satisfies demographic parity at each round when averaged over all possible information available before the selection. Finally, we use simulated settings and experiments on the US census data to show that our policy achieves sub-linear fair pseudo-regret also in practice.

We study the problem of best arm identification in a federated learning multi-armed bandit setup with a central server and multiple clients. Each client is associated with a multi-armed bandit in which each arm yields {\em i.i.d.}\ rewards following a Gaussian distribution with an unknown mean and known variance. The set of arms is assumed to be the same at all the clients. We define two notions of best arm -- local and global. The local best arm at a client is the arm with the largest mean among the arms local to the client, whereas the global best arm is the arm with the largest average mean across all the clients. We assume that each client can only observe the rewards from its local arms and thereby estimate its local best arm. The clients communicate with a central server on uplinks that entail a cost of $C\ge0$ units per usage per uplink. The global best arm is estimated at the server. The goal is to identify the local best arms and the global best arm with minimal total cost, defined as the sum of the total number of arm selections at all the clients and the total communication cost, subject to an upper bound on the error probability. We propose a novel algorithm {\sc FedElim} that is based on successive elimination and communicates only in exponential time steps and obtain a high probability instance-dependent upper bound on its total cost. The key takeaway from our paper is that for any $C\geq 0$ and error probabilities sufficiently small, the total number of arm selections (resp.\ the total cost) under {\sc FedElim} is at most~$2$ (resp.~$3$) times the maximum total number of arm selections under its variant that communicates in every time step. Additionally, we show that the latter is optimal in expectation up to a constant factor, thereby demonstrating that communication is almost cost-free in {\sc FedElim}. We numerically validate the efficacy of {\sc FedElim}.

We study the fundamental limits to the expressive power of neural networks. Given two sets $F$, $G$ of real-valued functions, we first prove a general lower bound on how well functions in $F$ can be approximated in $L^p(\mu)$ norm by functions in $G$, for any $p \geq 1$ and any probability measure $\mu$. The lower bound depends on the packing number of $F$, the range of $F$, and the fat-shattering dimension of $G$. We then instantiate this bound to the case where $G$ corresponds to a piecewise-polynomial feed-forward neural network, and describe in details the application to two sets $F$: H{\"o}lder balls and multivariate monotonic functions. Beside matching (known or new) upper bounds up to log factors, our lower bounds shed some light on the similarities or differences between approximation in $L^p$ norm or in sup norm, solving an open question by DeVore et al. (2021). Our proof strategy differs from the sup norm case and uses a key probability result of Mendelson (2002).

Is a sample rich enough to determine, at least locally, the parameters of a neural network? To answer this question, we introduce a new local parameterization of a given deep ReLU neural network by fixing the values of some of its weights. This allows us to define local lifting operators whose inverses are charts of a smooth manifold of a high dimensional space. The function implemented by the deep ReLU neural network composes the local lifting with a linear operator which depends on the sample. We derive from this convenient representation a geometrical necessary and sufficient condition of local identifiability. Looking at tangent spaces, the geometrical condition provides: 1/ a sharp and testable necessary condition of identifiability and 2/ a sharp and testable sufficient condition of local identifiability. The validity of the conditions can be tested numerically using backpropagation and matrix rank computations.

This paper extends quantile factor analysis to a probabilistic variant that incorporates regularization and computationally efficient variational approximations. By means of synthetic and real data experiments it is established that the proposed estimator can achieve, in many cases, better accuracy than a recently proposed loss-based estimator. We contribute to the literature on measuring uncertainty by extracting new indexes of low, medium and high economic policy uncertainty, using the probabilistic quantile factor methodology. Medium and high indexes have clear contractionary effects, while the low index is benign for the economy, showing that not all manifestations of uncertainty are the same.

In this paper, we develop a new algorithm, Annealed Skewed SGD - AskewSGD - for training deep neural networks (DNNs) with quantized weights. First, we formulate the training of quantized neural networks (QNNs) as a smoothed sequence of interval-constrained optimization problems. Then, we propose a new first-order stochastic method, AskewSGD, to solve each constrained optimization subproblem. Unlike algorithms with active sets and feasible directions, AskewSGD avoids projections or optimization under the entire feasible set and allows iterates that are infeasible. The numerical complexity of AskewSGD is comparable to existing approaches for training QNNs, such as the straight-through gradient estimator used in BinaryConnect, or other state of the art methods (ProxQuant, LUQ). We establish convergence guarantees for AskewSGD (under general assumptions for the objective function). Experimental results show that the AskewSGD algorithm performs better than or on par with state of the art methods in classical benchmarks.

We consider the problem of dynamic pricing of a product in the presence of feature-dependent price sensitivity. Developing practical algorithms that can estimate price elasticities robustly, especially when information about no purchases (losses) is not available, to drive such automated pricing systems is a challenge faced by many industries. Based on the Poisson semi-parametric approach, we construct a flexible yet interpretable demand model where the price related part is parametric while the remaining (nuisance) part of the model is non-parametric and can be modeled via sophisticated machine learning (ML) techniques. The estimation of price-sensitivity parameters of this model via direct one-stage regression techniques may lead to biased estimates due to regularization. To address this concern, we propose a two-stage estimation methodology which makes the estimation of the price-sensitivity parameters robust to biases in the estimators of the nuisance parameters of the model. In the first-stage we construct estimators of observed purchases and prices given the feature vector using sophisticated ML estimators such as deep neural networks. Utilizing the estimators from the first-stage, in the second-stage we leverage a Bayesian dynamic generalized linear model to estimate the price-sensitivity parameters. We test the performance of the proposed estimation schemes on simulated and real sales transaction data from the Airline industry. Our numerical studies demonstrate that our proposed two-stage approach reduces the estimation error in price-sensitivity parameters from 25\% to 4\% in realistic simulation settings. The two-stage estimation techniques proposed in this work allows practitioners to leverage modern ML techniques to robustly estimate price-sensitivities while still maintaining interpretability and allowing ease of validation of its various constituent parts.  ( 3 min )

We study the multiclass classification problem where the features come from the mixture of time-homogeneous diffusions. Specifically, the classes are discriminated by their drift functions while the diffusion coefficient is common to all classes and unknown. In this framework, we build a plug-in classifier which relies on nonparametric estimators of the drift and diffusion functions. We first establish the consistency of our classification procedure under mild assumptions and then provide rates of cnvergence under different set of assumptions. Finally, a numerical study supports our theoretical findings.

Bayesian optimization (BO), while proved highly effective for many black-box function optimization tasks, requires practitioners to carefully select priors that well model their functions of interest. Rather than specifying by hand, researchers have investigated transfer learning based methods to automatically learn the priors, e.g. multi-task BO (Swersky et al., 2013), few-shot BO (Wistuba and Grabocka, 2021) and HyperBO (Wang et al., 2022). However, those prior learning methods typically assume that the input domains are the same for all tasks, weakening their ability to use observations on functions with different domains or generalize the learned priors to BO on different search spaces. In this work, we present HyperBO+: a pre-training approach for hierarchical Gaussian processes that enables the same prior to work universally for Bayesian optimization on functions with different domains. We propose a two-step pre-training method and analyze its appealing asymptotic properties and benefits to BO both theoretically and empirically. On real-world hyperparameter tuning tasks that involve multiple search spaces, we demonstrate that HyperBO+ is able to generalize to unseen search spaces and achieves lower regrets than competitive baselines.

This paper investigates the problem of online statistical inference of model parameters in stochastic optimization problems via the Kiefer-Wolfowitz algorithm with random search directions. We first present the asymptotic distribution for the Polyak-Ruppert-averaging type Kiefer-Wolfowitz (AKW) estimators, whose asymptotic covariance matrices depend on the distribution of search directions and the function-value query complexity. The distributional result reflects the trade-off between statistical efficiency and function query complexity. We further analyze the choice of random search directions to minimize certain summary statistics of the asymptotic covariance matrix. Based on the asymptotic distribution, we conduct online statistical inference by providing two construction procedures of valid confidence intervals.  ( 2 min )

State-of-the-art performance in electroencephalography (EEG) decoding tasks is currently often achieved with either Deep-Learning or Riemannian-Geometry-based decoders. Recently, there is growing interest in Deep Riemannian Networks (DRNs) possibly combining the advantages of both previous classes of methods. However, there are still a range of topics where additional insight is needed to pave the way for a more widespread application of DRNs in EEG. These include architecture design questions such as network size and end-to-end ability as well as model training questions. How these factors affect model performance has not been explored. Additionally, it is not clear how the data within these networks is transformed, and whether this would correlate with traditional EEG decoding. Our study aims to lay the groundwork in the area of these topics through the analysis of DRNs for EEG with a wide range of hyperparameters. Networks were tested on two public EEG datasets and compared with state-of-the-art ConvNets. Here we propose end-to-end EEG SPDNet (EE(G)-SPDNet), and we show that this wide, end-to-end DRN can outperform the ConvNets, and in doing so use physiologically plausible frequency regions. We also show that the end-to-end approach learns more complex filters than traditional band-pass filters targeting the classical alpha, beta, and gamma frequency bands of the EEG, and that performance can benefit from channel specific filtering approaches. Additionally, architectural analysis revealed areas for further improvement due to the possible loss of Riemannian specific information throughout the network. Our study thus shows how to design and train DRNs to infer task-related information from the raw EEG without the need of handcrafted filterbanks and highlights the potential of end-to-end DRNs such as EE(G)-SPDNet for high-performance EEG decoding.  ( 2 min )

In this paper, we investigate the degree of explainability of graph neural networks (GNNs). Existing explainers work by finding global/local subgraphs to explain a prediction, but they are applied after a GNN has already been trained. Here, we propose a meta-learning framework for improving the level of explainability of a GNN directly at training time, by steering the optimization procedure towards what we call `interpretable minima'. Our framework (called MATE, MetA-Train to Explain) jointly trains a model to solve the original task, e.g., node classification, and to provide easily processable outputs for downstream algorithms that explain the model's decisions in a human-friendly way. In particular, we meta-train the model's parameters to quickly minimize the error of an instance-level GNNExplainer trained on-the-fly on randomly sampled nodes. The final internal representation relies upon a set of features that can be `better' understood by an explanation algorithm, e.g., another instance of GNNExplainer. Our model-agnostic approach can improve the explanations produced for different GNN architectures and use any instance-based explainer to drive this process. Experiments on synthetic and real-world datasets for node and graph classification show that we can produce models that are consistently easier to explain by different algorithms. Furthermore, this increase in explainability comes at no cost for the accuracy of the model.

Gaussian processes scale prohibitively with the size of the dataset. In response, many approximation methods have been developed, which inevitably introduce approximation error. This additional source of uncertainty, due to limited computation, is entirely ignored when using the approximate posterior. Therefore in practice, GP models are often as much about the approximation method as they are about the data. Here, we develop a new class of methods that provides consistent estimation of the combined uncertainty arising from both the finite number of data observed and the finite amount of computation expended. The most common GP approximations map to an instance in this class, such as methods based on the Cholesky factorization, conjugate gradients, and inducing points. For any method in this class, we prove (i) convergence of its posterior mean in the associated RKHS, (ii) decomposability of its combined posterior covariance into mathematical and computational covariances, and (iii) that the combined variance is a tight worst-case bound for the squared error between the method's posterior mean and the latent function. Finally, we empirically demonstrate the consequences of ignoring computational uncertainty and show how implicitly modeling it improves generalization performance on benchmark datasets.

Modelling interactions is critical in learning complex dynamical systems, namely systems of interacting objects with highly non-linear and time-dependent behaviour. A large class of such systems can be formalized as $\textit{geometric graphs}$, $\textit{i.e.}$, graphs with nodes positioned in the Euclidean space given an $\textit{arbitrarily}$ chosen global coordinate system, for instance vehicles in a traffic scene. Notwithstanding the arbitrary global coordinate system, the governing dynamics of the respective dynamical systems are invariant to rotations and translations, also known as $\textit{Galilean invariance}$. As ignoring these invariances leads to worse generalization, in this work we propose local coordinate frames per node-object to induce roto-translation invariance to the geometric graph of the interacting dynamical system. Further, the local coordinate frames allow for a natural definition of anisotropic filtering in graph neural networks. Experiments in traffic scenes, 3D motion capture, and colliding particles demonstrate that the proposed approach comfortably outperforms the recent state-of-the-art.  ( 2 min )

Topological data analysis (TDA) is an expanding field that leverages principles and tools from algebraic topology to quantify structural features of data sets or transform them into more manageable forms. As its theoretical foundations have been developed, TDA has shown promise in extracting useful information from high-dimensional, noisy, and complex data such as those used in biomedicine. To operate efficiently, these techniques may employ landmark samplers, either random or heuristic. The heuristic maxmin procedure obtains a roughly even distribution of sample points by implicitly constructing a cover comprising sets of uniform radius. However, issues arise with data that vary in density or include points with multiplicities, as are common in biomedicine. We propose an analogous procedure, "lastfirst" based on ranked distances, which implies a cover comprising sets of uniform cardinality. We first rigorously define the procedure and prove that it obtains landmarks with desired properties. We then perform benchmark tests and compare its performance to that of maxmin, on feature detection and class prediction tasks involving simulated and real-world biomedical data. Lastfirst is more general than maxmin in that it can be applied to any data on which arbitrary (and not necessarily symmetric) pairwise distances can be computed. Lastfirst is more computationally costly, but our implementation scales at the same rate as maxmin. We find that lastfirst achieves comparable performance on prediction tasks and outperforms maxmin on homology detection tasks. Where the numerical values of similarity measures are not meaningful, as in many biomedical contexts, lastfirst sampling may also improve interpretability.  ( 2 min )

The aim of this study is to define importance of predictors for black box machine learning methods, where the prediction function can be highly non-additive and cannot be represented by statistical parameters. In this paper we defined a ``Generalized Variable Importance Metric (GVIM)'' using the true conditional expectation function for a continuous or a binary response variable. We further showed that the defined GVIM can be represented as a function of the Conditional Average Treatment Effect (CATE) squared for multinomial and continuous predictors. Then we propose how the metric can be estimated using using any machine learning models. Finally we showed the properties of the estimator using multiple simulations.  ( 2 min )

We present in this paper a family of generalized simultaneous perturbation stochastic approximation (G-SPSA) estimators that estimate the gradient of the objective using noisy function measurements, but where the number of function measurements and the form of the gradient estimator is guided by the desired estimator bias. In particular, estimators with more function measurements are seen to result in lower bias. We provide an analysis of convergence of the generalized SPSA algorithm, and point to possible future directions.  ( 2 min )

This paper studies offline policy learning, which aims at utilizing observations collected a priori (from either fixed or adaptively evolving behavior policies) to learn an optimal individualized decision rule that achieves the best overall outcomes for a given population. Existing policy learning methods rely on a uniform overlap assumption, i.e., the propensities of exploring all actions for all individual characteristics are lower bounded in the offline dataset; put differently, the performance of the existing methods depends on the worst-case propensity in the offline dataset. As one has no control over the data collection process, this assumption can be unrealistic in many situations, especially when the behavior policies are allowed to evolve over time with diminishing propensities for certain actions. In this paper, we propose a new algorithm that optimizes lower confidence bounds (LCBs) -- instead of point estimates -- of the policy values. The LCBs are constructed using knowledge of the behavior policies for collecting the offline data. Without assuming any uniform overlap condition, we establish a data-dependent upper bound for the suboptimality of our algorithm, which only depends on (i) the overlap for the optimal policy, and (ii) the complexity of the policy class we optimize over. As an implication, for adaptively collected data, we ensure efficient policy learning as long as the propensities for optimal actions are lower bounded over time, while those for suboptimal ones are allowed to diminish arbitrarily fast. In our theoretical analysis, we develop a new self-normalized type concentration inequality for inverse-propensity-weighting estimators, generalizing the well-known empirical Bernstein's inequality to unbounded and non-i.i.d. data.  ( 2 min )

We explore the abilities of two machine learning approaches for no-arbitrage interpolation of European vanilla option prices, which jointly yield the corresponding local volatility surface: a finite dimensional Gaussian process (GP) regression approach under no-arbitrage constraints based on prices, and a neural net (NN) approach with penalization of arbitrages based on implied volatilities. We demonstrate the performance of these approaches relative to the SSVI industry standard. The GP approach is proven arbitrage-free, whereas arbitrages are only penalized under the SSVI and NN approaches. The GP approach obtains the best out-of-sample calibration error and provides uncertainty quantification.The NN approach yields a smoother local volatility and a better backtesting performance, as its training criterion incorporates a local volatility regularization term.  ( 2 min )

Cell-free multi-user multiple input multiple output networks are a promising alternative to classical cellular architectures, since they have the potential to provide uniform service quality and high resource utilisation over the entire coverage area of the network. To realise this potential, previous works have developed radio resource management mechanisms using various optimisation engines. In this work, we consider the problem of overall ergodic spectral efficiency maximisation in the context of uplink-downlink data power control in cell-free networks. To solve this problem in large networks, and to address convergence-time limitations, we apply scalable multi-objective Bayesian optimisation. Furthermore, we discuss how an intersection of multi-fidelity emulation and Bayesian optimisation can improve radio resource management in cell-free networks.  ( 2 min )

Bayesian methods, distributionally robust optimization methods, and regularization methods are three pillars of trustworthy machine learning hedging against distributional uncertainty, e.g., the uncertainty of an empirical distribution compared to the true underlying distribution. This paper investigates the connections among the three frameworks and, in particular, explores why these frameworks tend to have smaller generalization errors. Specifically, first, we suggest a quantitative definition for "distributional robustness", propose the concept of "robustness measure", and formalize several philosophical concepts in distributionally robust optimization. Second, we show that Bayesian methods are distributionally robust in the probably approximately correct (PAC) sense; In addition, by constructing a Dirichlet-process-like prior in Bayesian nonparametrics, it can be proven that any regularized empirical risk minimization method is equivalent to a Bayesian method. Third, we show that generalization errors of machine learning models can be characterized using the distributional uncertainty of the nominal distribution and the robustness measures of these machine learning models, which is a new perspective to bound generalization errors, and therefore, explain the reason why distributionally robust machine learning models, Bayesian models, and regularization models tend to have smaller generalization errors.  ( 2 min )

Object-centric representation is an essential abstraction for forward prediction. Most existing forward models learn this representation through extensive supervision (e.g., object class and bounding box) although such ground-truth information is not readily accessible in reality. To address this, we introduce KINet (Keypoint Interaction Network) -- an end-to-end unsupervised framework to reason about object interactions based on a keypoint representation. Using visual observations, our model learns to associate objects with keypoint coordinates and discovers a graph representation of the system as a set of keypoint embeddings and their relations. It then learns an action-conditioned forward model using contrastive estimation to predict future keypoint states. By learning to perform physical reasoning in the keypoint space, our model automatically generalizes to scenarios with a different number of objects, novel backgrounds, and unseen object geometries. Experiments demonstrate the effectiveness of our model in accurately performing forward prediction and learning plannable object-centric representations which can also be used in downstream robotic manipulation tasks.  ( 2 min )

This paper concerns with statistical estimation and inference for the ranking problems based on pairwise comparisons with additional covariate information such as the attributes of the compared items. Despite extensive studies, few prior literatures investigate this problem under the more realistic setting where covariate information exists. To tackle this issue, we propose a novel model, Covariate-Assisted Ranking Estimation (CARE) model, that extends the well-known Bradley-Terry-Luce (BTL) model, by incorporating the covariate information. Specifically, instead of assuming every compared item has a fixed latent score $\{\theta_i^*\}_{i=1}^n$, we assume the underlying scores are given by $\{\alpha_i^*+{x}_i^\top\beta^*\}_{i=1}^n$, where $\alpha_i^*$ and ${x}_i^\top\beta^*$ represent latent baseline and covariate score of the $i$-th item, respectively. We impose natural identifiability conditions and derive the $\ell_{\infty}$- and $\ell_2$-optimal rates for the maximum likelihood estimator of $\{\alpha_i^*\}_{i=1}^{n}$ and $\beta^*$ under a sparse comparison graph, using a novel `leave-one-out' technique (Chen et al., 2019) . To conduct statistical inferences, we further derive asymptotic distributions for the MLE of $\{\alpha_i^*\}_{i=1}^n$ and $\beta^*$ with minimal sample complexity. This allows us to answer the question whether some covariates have any explanation power for latent scores and to threshold some sparse parameters to improve the ranking performance. We improve the approximation method used in (Gao et al., 2021) for the BLT model and generalize it to the CARE model. Moreover, we validate our theoretical results through large-scale numerical studies and an application to the mutual fund stock holding dataset.  ( 2 min )

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hay, I've been playing with stable definition for a while and I was wondering if there was an AI chat bot I could self-host, if so what would the hardware requirements be for that AI bot? submitted by /u/Gnar8520 [link] [comments]  ( 49 min )

well finally I have something in common with AI, I produce buggy code, it does too!! We are like brothers now Computer scientists from Stanford University have found that programmers who accept help from AI tools like GitHub Copilot produce less secure code than those who fly solo. In a paper titled, "Do Users Write More Insecure Code with AI Assistants?", Stanford boffins Neil Perry, Megha Srivastava, Deepak Kumar, and Dan Boneh answer this question. Worse still, they found that AI help tends to delude developers about the quality of their output. "We found that participants with access to an AI assistant often produced more security vulnerabilities than those without access, with particularly significant results for string encryption and SQL injection," the authors state in their paper. "Surprisingly, we also found that participants provided access to an AI assistant were more likely to believe that they wrote secure code than those without access to the AI assistant.” The Stanford user study involved 47 people with varying levels of experience, including undergraduate students, graduate students, and industry professionals. Participants were asked to write code in response to five prompts while being monitored. By the end of the study, the authors concluded that AI assistants should be viewed with caution because they can mislead inexperienced developers and create security vulnerabilities. But they also hoped this study will force the developers of these AIs to work on the coding abilities of their systems before deploying. As one study participant is said to have remarked about AI assistance, "I hope this gets deployed. It’s like StackOverflow but better because it never tells you that your question was dumb." Comedy gold right there! ​ This is from the AI With Vibes Newsletter, read the full issue here: https://aiwithvibes.beehiiv.com/p/openai-releases-new-3d-generator-ai-study-shows-ai-helps-devs-produce-buggy-code submitted by /u/Mk_Makanaki [link] [comments]  ( 54 min )

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The purpose of this post is to encourage people in AI to consider an idea that I unfortunately am not in a position to execute. Idea: An intercom-like assistant with hundreds of AI and non-AI apps like image generator, writing generator, avatar generation, background verification etc. Today there's dozens of AI app platforms like Jasper AI, RunwayML etc. The challenge these guys face is companies like Notion, Canva building AI directly into their platform. Canva built an image generation app and Notion built an embedded writing AI. So how do the new AI companies compete? By exploiting the distribution of incumbents. Since every website wants to have these AI apps why not give them a little Javascript embed that gives them all these AI apps directly on their site. Imagine a small inter…  ( 64 min )

I had a beautiful image of me generated by Lensa AI but sadly the very top of my hair was cut off and so it’s not usable as a profile picture or anything really. Shame because it’s a stunning image. Is there an AI I can use to autocomplete or extend an image to fill out more space? Like add the top of my hair and extend the background out a bit past that? submitted by /u/Swftness503 [link] [comments]  ( 50 min )

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How I generated a full song with AI in less than 10 minutes: Ask ChatGPT for the lyrics. Turn the text into audio with Uberduck. Find a free for profit beat in YouTube. Mix both audios until it sounds good. It's ridiculously easy and entertaining! submitted by /u/TheVellerShow [link] [comments]  ( 69 min )

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I feel like ParlAI doesn't get a lot of attention in the machine learning community. Its no r/ChatGPT but it has a good framework to work with. I've been tinkering with it this week by setting up a Linux Guest System on my virtualbox and with the guidance of r/ChatGPT I was able to get a working chatbot. Its not perfect but at least its a good toy model that works. I supplied my own dataset by generating synthetic data from an endless conversation between EmersonAI and Blenderbot 3 via Selenium and I collected the text data and am currently expanding it as we speak but I decided to train it further, allocating more memory, increasing the max training time from 10 minutes to 30 minutes and increasing the batch size to 32. So what I want to know is has anyone else worked on ParlAI before? If so, what is the best task you've come across? ParlAI has a lot of tasks available, such as empathetic dialogues, convai2 and personachat. Which one would you prefer? submitted by /u/swagonflyyyy [link] [comments]  ( 51 min )

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I've been experimenting with GPT3 for different use cases over the past few weeks, the latest one was seeing how well it could parse out structured data from recipe free text, and how well it could further enrich this data. The general idea was to have a few different prompts to the model, with output from one prompt inputting into the next prompt: Extract ingredients and instructions from the recipe Given the ingredients, group them together into categories Given the full structured recipe generated above, enrich it further with additional metadata (time to cook, healthiness, etc) This worked out better than I expected - given an input recipe I'm able to consistently (and accurately) extract the constituent parts and group the ingredients together logically (like grains, dairy, etc). I wrote about it here: https://binal.pub/2022/12/extracting-and-structuring-recipes-using-gpt3/ One thing that I was surprised by as well was this turned out to be a decent recipe generator. So instead of using a full recipe I could input "Pumpkin Pie" and the structured response at the end would be the ingredients and instructions to bake a pumpkin pie with quantities/timings that seemed to be about what you'd expect. submitted by /u/caesarten [link] [comments]  ( 67 min )

Hi all, I need to train or fine-tune GPT on my customs data. So, I am looking if it is better to build a customs pc with gpu or use aws. I am will run a lot of experiments (new tech startup), so looking for cheap option. If a home pc is the best option, which gpu should I buy? thanks for your advice. submitted by /u/No-Trifle2470 [link] [comments]  ( 69 min )

I apologise if this has already been posted, but I came across this and thought you guys would be interested. You can make blobs sing in Opera style singing with the help of machine learning and you can record and share your singing blobs! https://artsandculture.google.com/experiment/blob-opera/AAHWrq360NcGbw?cp=eyJyIjoieUtyM0I3N1hPZ0lOIn0.&hl=en ​ https://preview.redd.it/skyw5to9ea7a1.png?width=1874&format=png&auto=webp&s=ef4a6024cecbd2657c1c1d4faaf261b727dfd434 submitted by /u/Kortax [link] [comments]  ( 66 min )

Hi, For my final year project for my BSc CompSci and AI course I’m implementing the world models paper to play games. Essentially a variational autoencoder and another network to predict future latent states of the game environment. The emphasis of my project is to reduce the number of parameters, and consequently the training time (making a case for reducing the energy consumption). I’ll use existing models and their size alongside game performance to compare with my own. I’ve had trouble finding existing literature as to how this can be done. Obviously there isn’t a way to find an ‘optimal’ number required to solve a task, but wanted to find techniques to reduce excess bulk in a NN without sacrificing performance. Does anyone have any ideas or know of any resources? TIA submitted by /u/ackbladder_ [link] [comments]  ( 67 min )

Is anyone aware of any huge datasets I can use? I've done some Googling and I found a few of them but they all seem to be for 2017 and earlier. submitted by /u/Careful-Temporary388 [link] [comments]  ( 64 min )

Whisperer A tool to make audio-text datasets automatically for your ML Projects. Two weeks ago, I shared an early draft of a project based on the newly released OpenAI's Whisper. Today I'm sharing the finished version of Whisperer, which adds diarization, with same-speaker detection across multiple audio files. Key Features: Automatic Speaker Diarization Automatic Speaker Identification e.g: same speakers across audio files Automatic Transcription Forces Gaussian Distributions of the dataset see notebook Modular and Configurable EDIT: Live on twitch if anyone has any questions. submitted by /u/pigmentedink [link] [comments]  ( 68 min )

There's a lot of small things like filling NaNs, altering columns, normalizing and splitting data, etc. Does anyone have a small code sheet cheat to refer to when prepping any new data? submitted by /u/_xxx420xblazexitx___ [link] [comments]  ( 72 min )

There is a whole more to pooling than Max and average pooling. A few other Pooling methods are: Mixed Pooling L_p Pooling Stochastic Pooling Spatial pyramid Pooling Multi-scale order less Pooling Super Pixel Pooling Compact bilinear Pooling Edge-aware Pyramid Pooling Spectral Pooling Per-Pixel Pyramid Pooling Rank Based average Pooling Weighted Pooling Genetic-based Pooling Read the full article here: https://medium.com/aiguys/pooling-layers-in-neural-nets-and-their-variants-f6129fc4628b ​ https://preview.redd.it/6plxeqvts87a1.png?width=517&format=png&auto=webp&s=cb6b9da6c18f0c571cfbe8b0844e0443b311101e submitted by /u/Difficult-Race-1188 [link] [comments]  ( 66 min )

It's only been a month since OpenAI released ChatGPT, and yesterday they launched Point-E, a new Dalle-like model that generates 3D Point Clouds from Complex Prompts. As someone who is always interested in the latest advancements in machine learning, I was really excited to dig into this paper and see what it had to offer. One of the key features of Point-E is its use of diffusion models to generate synthetic views and 3D point clouds. These models use text input to generate an image, which is then used as a reference for generating the 3D point cloud. This process takes only 1-2 minutes on a single GPU, making it much faster than previous state-of-the-art methods. While the quality of the samples produced by Point-E may be lower than those produced by other methods, the speed of generation makes it a practical option for certain use cases. If you're interested in learning more about this new model and how it was developed, I highly recommend giving the full paper a read. But if you're more into reading the gist of it, I added a link to an overview blog I published about. The blog: https://dagshub.com/blog/overview-of-point-e/ The paper: https://arxiv.org/abs/2212.08751 I'm sure I have yet to reach all the insights while writing the blog, and I'd love to get your thoughts about the model and how OpenAI developed it. submitted by /u/RepresentativeCod613 [link] [comments]  ( 72 min )

I believe it is always better to cite the version of a paper that has been published in a conference or journal, if such a version exists. ​ However, I often find myself adding the arxiv version to my bibliography manager when I quickly want to save a paper. I presume many of you do the same. ​ Before submitting my paper, I can manually search for every reference on google or semanticscholar (google scholar does not always find the conference version in my experience) and replace the arxiv reference with the conference reference. Sounds like that could be automated, right? ​ Whats your workflow in that regard? Are you aware of a tool to automate the process? Or do you even care which version you cite? submitted by /u/_Arsenie_Boca_ [link] [comments]  ( 68 min )

BLIP from Salesforce is now available on Hugging Face transformers! Here is a list of cool applications you can build on top of it: https://twitter.com/younesbelkada/status/1605489647395540992 With (I think) most interesting application being building image-captioning APIs and Stable Diffusion-related applications (generate image-text datasets to fine-tune Stable Diffusion on it & image to music app) Any other thing you have in mind that can be built using BLIP? submitted by /u/younesbelkada [link] [comments]  ( 69 min )

Many recently published llms (gpt, bloom, palm, etc) evaluate on a plethora of tasks in a k-shot setting, and offer evaluations on different model sizes with the same architecture. However, I haven't seen much literature evaluating these models' capabilities for finetuning to individual tasks. Are there resources out there that do this comparison? It would help for deciding what pretrained backbone to use for finetuning in production usecases. submitted by /u/idioticfuse [link] [comments]  ( 69 min )

Hi Guys, I'm looking for a paper, which was published in NIPS around 2016, in which the authors used a neural network, to predict the weights of another neural network, I don't have the context in which this was applied :(. Does this sound familiar? submitted by /u/schlodinger [link] [comments]  ( 67 min )

I'm trying to figure out how to go about running something like GPT-J, FLAN-T5, etc, on my PC, without using cloud compute services (because privacy and other reasons). However, GPT-J-6B needs either ~14 GB of VRAM or 4x as much plain RAM. Upgrading my PC for 48 GB of RAM is possible, and 16, 24 GB graphics cards are available for general public (though they cost as much as a car), but anything beyond that is in the realm of HPC, datacenter hardware and "GPU accelerators"... I.e. 128 GB GPUs exist out there somewhere, but the distributors don't even list a price, it's just "get a quote" and "contact us"... meaning it's super expensive and you need to be a CEO of medium-sized company for them to even talk to you? I'm trying to figure out if it's possible to run the larger models (e.g. 175B GPT-3 equivalents) on consumer hardware, perhaps by doing a very slow emulation using one or several PCs such that their collective RAM (or swap SDD space) matches the VRAM needed for those beasts. So the question is "will it run super slowly" or "will it fail immediately due to completely incompatible software / being impossible to configure for anything other than real datacenter hardware"? submitted by /u/Zondartul [link] [comments]  ( 70 min )

The main issue I have with GPT-3 is that the output can be compelling, yet factually incorrect. I remember discovering a platform that generates answers alongside sources, but I can't recall the name. submitted by /u/EntireInflation8663 [link] [comments]  ( 77 min )

Posted by Jinsung Yoon and Sercan O. Arik, Research Scientists, Google Research, Cloud AI Team Analysis of Electronic Health Records (EHR) has a tremendous potential for enhancing patient care, quantitatively measuring performance of clinical practices, and facilitating clinical research. Statistical estimation and machine learning (ML) models trained on EHR data can be used to predict the probability of various diseases (such as diabetes), track patient wellness, and predict how patients respond to specific drugs. For such models, researchers and practitioners need access to EHR data. However, it can be challenging to leverage EHR data while ensuring data privacy and conforming to patient confidentiality regulations (such as HIPAA). Conventional methods to anonymize data (e.g., de-id…  ( 93 min )

submitted by /u/fillsoko [link] [comments]  ( 46 min )

Is machine judgement truly noise-free?  ( 14 min )

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Auto-encoders are an unsupervised learning technique using neural networks to learn representations.  ( 11 min )

On the well-known iris dataset, we will perform the neural network operation here without writing a single line of Python code. Sounds…  ( 11 min )

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Artificial intelligence (AI) has been a hot topic in the tech industry for years, and it’s no surprise that AI tools like ChatGPT are…  ( 8 min )

Linear regression is one of the main algorithms that you must master as a data scientist, you will learn how to build your first model…  ( 11 min )

Amazon Kendra is a highly accurate and simple-to-use intelligent search service powered by machine learning (ML). Amazon Kendra offers a suite of data source connectors to simplify the process of ingesting and indexing your content, wherever it resides. Valuable data in organizations is stored in both structured and unstructured repositories. An enterprise search solution should […]  ( 7 min )